N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide

C14H20N4O — CID 109319648

IUPACN-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)nc(NC2CC2)n1
InChIInChI=1S/C14H20N4O/c1-9-8-12(13(19)16-10-4-2-3-5-10)18-14(15-9)17-11-6-7-11/h8,10-11H,2-7H2,1H3,(H,16,19)(H,15,17,18)
InChIKeyMRMGHLARZWHXJB-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.03
Rot. Bonds4

About N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide

N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide (PubChem CID 109319648) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide
PubChem CID109319648
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)nc(NC2CC2)n1
InChIInChI=1S/C14H20N4O/c1-9-8-12(13(19)16-10-4-2-3-5-10)18-14(15-9)17-11-6-7-11/h8,10-11H,2-7H2,1H3,(H,16,19)(H,15,17,18)
InChIKeyMRMGHLARZWHXJB-UHFFFAOYSA-N
XLogP2.03
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-6-methyl-2-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 109319258
2-(cycloheptylamino)-N-(1,1-dioxothiolan-3-yl)-6-methylpyrimidine-4-carboxamide
CID 109331364
2-(cyclohexylamino)-6-methyl-N-propylpyrimidine-4-carboxamide
CID 109319065
N-tert-butyl-2-(cycloheptylamino)-6-methylpyrimidine-4-carboxamide
CID 109332725
N-butyl-2-(cyclopentylamino)-6-methylpyrimidine-4-carboxamide
CID 109320611
2-(cyclopentylamino)-N-(3,5-dimethylphenyl)-6-methylpyrimidine-4-carboxamide
CID 109322002
2-(cyclopentylamino)-6-methyl-N-(2-methylpropyl)pyrimidine-4-carboxamide
CID 109320990
2-anilino-N-cyclopentyl-6-methylpyrimidine-4-carboxamide
CID 109322174
2-(cycloheptylamino)-6-methyl-N-(3-methylbutyl)pyrimidine-4-carboxamide
CID 109332847
N-(4-acetamidophenyl)-2-(cyclohexylamino)-6-methylpyrimidine-4-carboxamide
CID 109322742
N-butan-2-yl-2-(cyclopentylamino)-6-methylpyrimidine-4-carboxamide
CID 109321370
2-(cyclohexylamino)-N-[3-(dimethylamino)propyl]-6-methylpyrimidine-4-carboxamide
CID 109322624

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide (CID 109319648) is N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide is Cc1cc(C(=O)NC2CCCC2)nc(NC2CC2)n1.
What is the InChIKey of N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide?
The InChIKey is MRMGHLARZWHXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9-8-12(13(19)16-10-4-2-3-5-10)18-14(15-9)17-11-6-7-11/h8,10-11H,2-7H2,1H3,(H,16,19)(H,15,17,18).
What are the key properties of N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide?
N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 109319648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).