N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide

C18H25N5O — CID 71835761

IUPACN-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide
SMILESCCN(CC)c1nc(C(=O)NCC2CC2)nc2nc(C)cc(C)c12
InChIInChI=1S/C18H25N5O/c1-5-23(6-2)17-14-11(3)9-12(4)20-15(14)21-16(22-17)18(24)19-10-13-7-8-13/h9,13H,5-8,10H2,1-4H3,(H,19,24)
InChIKeyNLKXMFDYHYMPDI-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.63
Rot. Bonds6

About N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide

N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide (PubChem CID 71835761) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide
PubChem CID71835761
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC NameN-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide
SMILESCCN(CC)c1nc(C(=O)NCC2CC2)nc2nc(C)cc(C)c12
InChIInChI=1S/C18H25N5O/c1-5-23(6-2)17-14-11(3)9-12(4)20-15(14)21-16(22-17)18(24)19-10-13-7-8-13/h9,13H,5-8,10H2,1-4H3,(H,19,24)
InChIKeyNLKXMFDYHYMPDI-UHFFFAOYSA-N
XLogP2.63
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]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

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide (CID 71835761) is N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide is CCN(CC)c1nc(C(=O)NCC2CC2)nc2nc(C)cc(C)c12.
What is the InChIKey of N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide?
The InChIKey is NLKXMFDYHYMPDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-5-23(6-2)17-14-11(3)9-12(4)20-15(14)21-16(22-17)18(24)19-10-13-7-8-13/h9,13H,5-8,10H2,1-4H3,(H,19,24).
What are the key properties of N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide?
N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-4-(diethylamino)-5,7-dimethylpyrido[2,3-d]pyrimidine-2-carboxamide is sourced from PubChem (CID 71835761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).