6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide

C14H24N4O — CID 109320796

IUPAC6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCC(C)C)nc(NCC(C)C)n1
InChIInChI=1S/C14H24N4O/c1-9(2)7-15-13(19)12-6-11(5)17-14(18-12)16-8-10(3)4/h6,9-10H,7-8H2,1-5H3,(H,15,19)(H,16,17,18)
InChIKeyAWJNNGJHMILCQB-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.24
Rot. Bonds6

About 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide

6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide (PubChem CID 109320796) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide
PubChem CID109320796
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCC(C)C)nc(NCC(C)C)n1
InChIInChI=1S/C14H24N4O/c1-9(2)7-15-13(19)12-6-11(5)17-14(18-12)16-8-10(3)4/h6,9-10H,7-8H2,1-5H3,(H,15,19)(H,16,17,18)
InChIKeyAWJNNGJHMILCQB-UHFFFAOYSA-N
XLogP2.24
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-fluorophenyl)methylamino]-6-methyl-N-(2-methylpropyl)pyrimidine-4-carboxamide
CID 109321011
N,N-diethyl-6-methyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320864
2-(cyclopentylamino)-6-methyl-N-(2-methylpropyl)pyrimidine-4-carboxamide
CID 109320990
6-methyl-2-(2-methylpropylamino)-N-(4-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109320900
N-(2-chlorophenyl)-6-methyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320908
2-(2-bromoanilino)-6-methyl-N-(2-methylpropyl)pyrimidine-4-carboxamide
CID 109321144
N-[4-(dimethylamino)phenyl]-6-methyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320944
methyl 4-[[6-methyl-2-(2-methylpropylamino)pyrimidine-4-carbonyl]amino]benzoate
CID 109320941
N-butyl-N,6-dimethyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320873
6-methyl-N-(2-methylpropyl)-2-(2,3,4-trifluoroanilino)pyrimidine-4-carboxamide
CID 109321174
6-methyl-N-(2-methylpropyl)-2-(3,4,5-trimethoxyanilino)pyrimidine-4-carboxamide
CID 109321155
2-[2-(1H-indol-3-yl)ethylamino]-6-methyl-N-(2-methylpropyl)pyrimidine-4-carboxamide
CID 109321035

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide?
The IUPAC name of 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide (CID 109320796) is 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide.
What is the SMILES notation for 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide?
The canonical SMILES for 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide is Cc1cc(C(=O)NCC(C)C)nc(NCC(C)C)n1.
What is the InChIKey of 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide?
The InChIKey is AWJNNGJHMILCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-9(2)7-15-13(19)12-6-11(5)17-14(18-12)16-8-10(3)4/h6,9-10H,7-8H2,1-5H3,(H,15,19)(H,16,17,18).
What are the key properties of 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide?
6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-methylpropyl)-2-(2-methylpropylamino)pyrimidine-4-carboxamide is sourced from PubChem (CID 109320796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).