4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide

C19H32N6O2 — CID 146113583

IUPAC4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide
SMILESCc1nc(C(=O)N(C)CCCN2CCOCC2)nc(N2CC[C@@H](N)C2)c1C
InChIInChI=1S/C19H32N6O2/c1-14-15(2)21-17(22-18(14)25-8-5-16(20)13-25)19(26)23(3)6-4-7-24-9-11-27-12-10-24/h16H,4-13,20H2,1-3H3/t16-/m1/s1
InChIKeyRLKMMXSDNJGAFC-MRXNPFEDSA-N
MW376.51 g/mol
LogP0.43
Rot. Bonds6

About 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide

4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide (PubChem CID 146113583) has the molecular formula C19H32N6O2 and a molecular weight of 376.51 g/mol. Its IUPAC name is 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide.

Molecular Properties

Compound Name4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide
PubChem CID146113583
Molecular FormulaC19H32N6O2
Molecular Weight376.51 g/mol
Exact Mass376.26
IUPAC Name4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide
SMILESCc1nc(C(=O)N(C)CCCN2CCOCC2)nc(N2CC[C@@H](N)C2)c1C
InChIInChI=1S/C19H32N6O2/c1-14-15(2)21-17(22-18(14)25-8-5-16(20)13-25)19(26)23(3)6-4-7-24-9-11-27-12-10-24/h16H,4-13,20H2,1-3H3/t16-/m1/s1
InChIKeyRLKMMXSDNJGAFC-MRXNPFEDSA-N
XLogP0.43
TPSA87.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.51
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide 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

4-[(3R)-3-aminopyrrolidin-1-yl]-N-(furan-2-ylmethyl)-N,5,6-trimethylpyrimidine-2-carboxamide
CID 167816129
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(6,6-dimethyl-1,4-oxazepan-4-yl)methanone
CID 146113579
4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-(2-imidazol-1-ylethyl)-N,5,6-trimethylpyrimidine-2-carboxamide
CID 146101421
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(7-azaspiro[4.6]undecan-7-yl)methanone
CID 154794358
4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]pyrimidine-2-carboxamide
CID 167928915
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(4-propan-2-yl-1,4-diazepan-1-yl)methanone
CID 146150377
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(9-azaspiro[5.6]dodecan-9-yl)methanone
CID 146101170
[4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-[3-(oxan-4-yl)azetidin-1-yl]methanone
CID 146110864
N-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 67379055
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 146153943
[4-[(3R)-3-aminopyrrolidin-1-yl]-5,6-dimethylpyrimidin-2-yl]-(7,7-dimethyl-1,4-diazepan-1-yl)methanone
CID 146150378
N-(cyanomethyl)-4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-5,6-dimethylpyrimidine-2-carboxamide
CID 154879384

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide?
The IUPAC name of 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide (CID 146113583) is 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide.
What is the SMILES notation for 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide?
The canonical SMILES for 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide is Cc1nc(C(=O)N(C)CCCN2CCOCC2)nc(N2CC[C@@H](N)C2)c1C.
What is the InChIKey of 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide?
The InChIKey is RLKMMXSDNJGAFC-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H32N6O2/c1-14-15(2)21-17(22-18(14)25-8-5-16(20)13-25)19(26)23(3)6-4-7-24-9-11-27-12-10-24/h16H,4-13,20H2,1-3H3/t16-/m1/s1.
What are the key properties of 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide?
4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide has a molecular weight of 376.51 g/mol, XLogP of 0.43, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-aminopyrrolidin-1-yl]-N,5,6-trimethyl-N-(3-morpholin-4-ylpropyl)pyrimidine-2-carboxamide is sourced from PubChem (CID 146113583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).