N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide

C20H26N4O — CID 109363342

IUPACN-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide
SMILESCCc1cccc(C)c1Nc1cc(C(=O)NC2CCCC2)nc(C)n1
InChIInChI=1S/C20H26N4O/c1-4-15-9-7-8-13(2)19(15)24-18-12-17(21-14(3)22-18)20(25)23-16-10-5-6-11-16/h7-9,12,16H,4-6,10-11H2,1-3H3,(H,23,25)(H,21,22,24)
InChIKeyIXPRNLXSCKSHBJ-UHFFFAOYSA-N
MW338.46 g/mol
LogP4.07
Rot. Bonds5

About N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide

N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide (PubChem CID 109363342) has the molecular formula C20H26N4O and a molecular weight of 338.46 g/mol. Its IUPAC name is N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide
PubChem CID109363342
Molecular FormulaC20H26N4O
Molecular Weight338.46 g/mol
Exact Mass338.21
IUPAC NameN-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide
SMILESCCc1cccc(C)c1Nc1cc(C(=O)NC2CCCC2)nc(C)n1
InChIInChI=1S/C20H26N4O/c1-4-15-9-7-8-13(2)19(15)24-18-12-17(21-14(3)22-18)20(25)23-16-10-5-6-11-16/h7-9,12,16H,4-6,10-11H2,1-3H3,(H,23,25)(H,21,22,24)
InChIKeyIXPRNLXSCKSHBJ-UHFFFAOYSA-N
XLogP4.07
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-6-(2,6-dimethylanilino)-2-methylpyrimidine-4-carboxamide
CID 109361061
N-cyclopropyl-6-(2-ethyl-6-methylanilino)pyrimidine-4-carboxamide
CID 109339321
6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxylic acid
CID 82306131
6-N-cyclopentyl-2-N-(2-ethyl-6-methylphenyl)pyridine-2,6-dicarboxamide
CID 109095024
6-(2,6-dimethylanilino)-N-(1,1-dioxothiolan-3-yl)-2-methylpyrimidine-4-carboxamide
CID 109372464
N-cyclohexyl-2-methyl-6-(3-methylanilino)pyrimidine-4-carboxamide
CID 109364005
6-(3-bromo-4-methylanilino)-N-cyclopentyl-2-methylpyrimidine-4-carboxamide
CID 109363363
N-cyclopropyl-6-[2,6-di(propan-2-yl)anilino]-2-methylpyrimidine-4-carboxamide
CID 109361130
6-(3-chloroanilino)-N-cyclohexyl-2-methylpyrimidine-4-carboxamide
CID 109364026
N-butyl-6-(2,6-dimethylanilino)-2-methylpyrimidine-4-carboxamide
CID 109361834
N-cyclohexyl-6-(2-ethoxyanilino)-2-methylpyrimidine-4-carboxamide
CID 109364039
N-cyclopentyl-6-(3,5-dimethylanilino)-2-methylpyrimidine-4-carboxamide
CID 109363336

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide (CID 109363342) is N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide is CCc1cccc(C)c1Nc1cc(C(=O)NC2CCCC2)nc(C)n1.
What is the InChIKey of N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide?
The InChIKey is IXPRNLXSCKSHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-4-15-9-7-8-13(2)19(15)24-18-12-17(21-14(3)22-18)20(25)23-16-10-5-6-11-16/h7-9,12,16H,4-6,10-11H2,1-3H3,(H,23,25)(H,21,22,24).
What are the key properties of N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide?
N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide has a molecular weight of 338.46 g/mol, XLogP of 4.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(2-ethyl-6-methylanilino)-2-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 109363342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).