N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride

C19H29Cl2N5O3 — CID 119553350

IUPACN-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N(C)C3CCNC3)cc(C(C)C)nc21.Cl.Cl
InChIInChI=1S/C19H27N5O3.2ClH/c1-5-8-24-16-15(17(25)22-19(24)27)13(9-14(21-16)11(2)3)18(26)23(4)12-6-7-20-10-12;;/h9,11-12,20H,5-8,10H2,1-4H3,(H,22,25,27);2*1H
InChIKeyYIHLDJAYMXQIPS-UHFFFAOYSA-N
MW446.38 g/mol
LogP1.90
Rot. Bonds5

About N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride

N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride (PubChem CID 119553350) has the molecular formula C19H29Cl2N5O3 and a molecular weight of 446.38 g/mol. Its IUPAC name is N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride
PubChem CID119553350
Molecular FormulaC19H29Cl2N5O3
Molecular Weight446.38 g/mol
Exact Mass445.16
IUPAC NameN-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N(C)C3CCNC3)cc(C(C)C)nc21.Cl.Cl
InChIInChI=1S/C19H27N5O3.2ClH/c1-5-8-24-16-15(17(25)22-19(24)27)13(9-14(21-16)11(2)3)18(26)23(4)12-6-7-20-10-12;;/h9,11-12,20H,5-8,10H2,1-4H3,(H,22,25,27);2*1H
InChIKeyYIHLDJAYMXQIPS-UHFFFAOYSA-N
XLogP1.90
TPSA100.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.38
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dioxo-N-(piperidin-3-ylmethyl)-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride
CID 119463221
1-ethyl-2,4-dioxo-7-propan-2-yl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride
CID 119453510
N-(2-aminoethyl)-2,4-dioxo-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 119384530
5-[3-(aminomethyl)pyrrolidine-1-carbonyl]-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 119486108
N-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2,4-dioxo-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 56537653
5-(2-methylmorpholine-4-carbonyl)-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 134054087
N-(cyclopropylmethyl)-1-(2-methylpropyl)-2,4-dioxo-7-propan-2-yl-N-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 55921428
N,3-dimethyl-6-propan-2-yl-N-pyrrolidin-3-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119551327
5-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carbonyl]-1-ethyl-7-propan-2-ylpyrido[2,3-d]pyrimidine-2,4-dione
CID 120659133
3-[(7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carbonyl)-methylamino]-2-methylpropanoic acid
CID 122111825
N-methyl-2-propan-2-yl-N-pyrrolidin-3-ylquinoline-4-carboxamide;dihydrochloride
CID 119554410
N-[[6-(dimethylamino)-3-pyridinyl]methyl]-2,4-dioxo-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 55620756

Frequently Asked Questions

What is the IUPAC name of N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride (CID 119553350) is N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride is CCCn1c(=O)[nH]c(=O)c2c(C(=O)N(C)C3CCNC3)cc(C(C)C)nc21.Cl.Cl.
What is the InChIKey of N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride?
The InChIKey is YIHLDJAYMXQIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O3.2ClH/c1-5-8-24-16-15(17(25)22-19(24)27)13(9-14(21-16)11(2)3)18(26)23(4)12-6-7-20-10-12;;/h9,11-12,20H,5-8,10H2,1-4H3,(H,22,25,27);2*1H.
What are the key properties of N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride?
N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride has a molecular weight of 446.38 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-N-pyrrolidin-3-ylpyrido[2,3-d]pyrimidine-5-carboxamide;dihydrochloride is sourced from PubChem (CID 119553350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).