N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide

C19H23N3O3 — CID 50974846

IUPACN-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESO=C(c1cnc2ccccn2c1=O)N(CC1CCC1)CC1CCCO1
InChIInChI=1S/C19H23N3O3/c23-18(16-11-20-17-8-1-2-9-22(17)19(16)24)21(12-14-5-3-6-14)13-15-7-4-10-25-15/h1-2,8-9,11,14-15H,3-7,10,12-13H2
InChIKeyVBRPPEJYQLGPIS-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.12
Rot. Bonds5

About N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide

N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 50974846) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID50974846
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESO=C(c1cnc2ccccn2c1=O)N(CC1CCC1)CC1CCCO1
InChIInChI=1S/C19H23N3O3/c23-18(16-11-20-17-8-1-2-9-22(17)19(16)24)21(12-14-5-3-6-14)13-15-7-4-10-25-15/h1-2,8-9,11,14-15H,3-7,10,12-13H2
InChIKeyVBRPPEJYQLGPIS-UHFFFAOYSA-N
XLogP2.12
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclobutylmethyl)-4-methyl-N-(oxolan-2-ylmethyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137334645
N,N-bis(2-methylpropyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 71941067
N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide
CID 163772430
N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
CID 74234326
N-ethyl-N-(3-hydroxypropyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 115771474
N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-6-oxo-N-(oxolan-2-ylmethyl)-1H-pyrimidine-5-carboxamide
CID 72848069
N-(cyclobutylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]-1-benzofuran-2-carboxamide
CID 95225190
N-(cyclobutylmethyl)-2-(ethylamino)-N-[[(2S)-oxolan-2-yl]methyl]pyrimidine-5-carboxamide
CID 97147899
N-[(1,1-dioxothian-4-yl)methyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 118789772
N-(2-amino-2-oxoethyl)-N-butyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 56795807
2-benzyl-N-(cyclobutylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,3-thiazole-4-carboxamide
CID 96571936
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 107482606

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide (CID 50974846) is N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide is O=C(c1cnc2ccccn2c1=O)N(CC1CCC1)CC1CCCO1.
What is the InChIKey of N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is VBRPPEJYQLGPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c23-18(16-11-20-17-8-1-2-9-22(17)19(16)24)21(12-14-5-3-6-14)13-15-7-4-10-25-15/h1-2,8-9,11,14-15H,3-7,10,12-13H2.
What are the key properties of N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide?
N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.12, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)pyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 50974846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).