5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide

C14H17N5O — CID 106937249

IUPAC5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide
SMILESCC(C)c1ncc(N)c(C(=O)N(C)c2ccncc2)n1
InChIInChI=1S/C14H17N5O/c1-9(2)13-17-8-11(15)12(18-13)14(20)19(3)10-4-6-16-7-5-10/h4-9H,15H2,1-3H3
InChIKeySFGINUCEFKGJDY-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.85
Rot. Bonds3

About 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide

5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide (PubChem CID 106937249) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide
PubChem CID106937249
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide
SMILESCC(C)c1ncc(N)c(C(=O)N(C)c2ccncc2)n1
InChIInChI=1S/C14H17N5O/c1-9(2)13-17-8-11(15)12(18-13)14(20)19(3)10-4-6-16-7-5-10/h4-9H,15H2,1-3H3
InChIKeySFGINUCEFKGJDY-UHFFFAOYSA-N
XLogP1.85
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-ethyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62155107
3-amino-N-methyl-N-pyridin-4-ylpyridine-2-carboxamide
CID 106934951
5-amino-N-methyl-N-(2-methylsulfonylethyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 79864352
5-amino-N-(2-methoxyethyl)-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 55041532
5-amino-N-(2-ethoxyethyl)-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 81074196
5-amino-N-(2,2-dimethylpropyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 62161344
5-amino-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpyrimidine-4-carboxamide
CID 63275010
5-amino-N-butan-2-yl-N-butyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62186030
5-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 107486025
6-amino-N-methyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 106937214
5-chloro-N-methyl-2-propan-2-yl-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide
CID 62017148
N,4-dimethyl-2-propan-2-yl-N-pyridazin-4-ylpyrimidine-5-carboxamide
CID 53492979

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide?
The IUPAC name of 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide (CID 106937249) is 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide?
The canonical SMILES for 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide is CC(C)c1ncc(N)c(C(=O)N(C)c2ccncc2)n1.
What is the InChIKey of 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide?
The InChIKey is SFGINUCEFKGJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-9(2)13-17-8-11(15)12(18-13)14(20)19(3)10-4-6-16-7-5-10/h4-9H,15H2,1-3H3.
What are the key properties of 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide?
5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-2-propan-2-yl-N-pyridin-4-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 106937249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).