N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide

C19H24N4O — CID 109249624

IUPACN-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide
SMILESCc1cc(C)c(Nc2ncc(C(=O)NC3CCCC3)cn2)c(C)c1
InChIInChI=1S/C19H24N4O/c1-12-8-13(2)17(14(3)9-12)23-19-20-10-15(11-21-19)18(24)22-16-6-4-5-7-16/h8-11,16H,4-7H2,1-3H3,(H,22,24)(H,20,21,23)
InChIKeyDXKVPFZESPCHIA-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.82
Rot. Bonds4

About N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide

N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide (PubChem CID 109249624) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide
PubChem CID109249624
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide
SMILESCc1cc(C)c(Nc2ncc(C(=O)NC3CCCC3)cn2)c(C)c1
InChIInChI=1S/C19H24N4O/c1-12-8-13(2)17(14(3)9-12)23-19-20-10-15(11-21-19)18(24)22-16-6-4-5-7-16/h8-11,16H,4-7H2,1-3H3,(H,22,24)(H,20,21,23)
InChIKeyDXKVPFZESPCHIA-UHFFFAOYSA-N
XLogP3.82
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-(3,4-dimethylanilino)pyrimidine-5-carboxamide
CID 109263097
5-N-cyclopentyl-3-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109102757
N-cyclopentyl-2-(2-methyl-6-propan-2-ylanilino)pyrimidine-5-carboxamide
CID 109249626
N-tert-butyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide
CID 109262869
N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]pyrimidine-5-carboxamide
CID 109250432
N-cyclohexyl-2-(2,3-dimethylanilino)pyrimidine-5-carboxamide
CID 109250365
2-(2,6-dimethylanilino)-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
CID 109267067
N-pentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide
CID 109263658
2-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249701
2-(tert-butylamino)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249591
2-(4-chloro-2-methoxy-5-methylanilino)-N-cyclohexylpyrimidine-5-carboxamide
CID 109250448
N-cyclopentyl-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109249542

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide (CID 109249624) is N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide is Cc1cc(C)c(Nc2ncc(C(=O)NC3CCCC3)cn2)c(C)c1.
What is the InChIKey of N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide?
The InChIKey is DXKVPFZESPCHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-12-8-13(2)17(14(3)9-12)23-19-20-10-15(11-21-19)18(24)22-16-6-4-5-7-16/h8-11,16H,4-7H2,1-3H3,(H,22,24)(H,20,21,23).
What are the key properties of N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide?
N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2,4,6-trimethylanilino)pyrimidine-5-carboxamide is sourced from PubChem (CID 109249624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).