N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide

C17H26N4O — CID 109341807

IUPACN-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C17H26N4O/c22-17(21-14-9-5-2-6-10-14)15-11-16(19-12-18-15)20-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,21,22)(H,18,19,20)
InChIKeyIYJWDZFWCNNKIA-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.28
Rot. Bonds4

About N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide

N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide (PubChem CID 109341807) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide
PubChem CID109341807
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C17H26N4O/c22-17(21-14-9-5-2-6-10-14)15-11-16(19-12-18-15)20-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,21,22)(H,18,19,20)
InChIKeyIYJWDZFWCNNKIA-UHFFFAOYSA-N
XLogP3.28
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,6-N-dicyclohexylpyrimidine-4,6-dicarboxamide
CID 131994880
6-(cycloheptylamino)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
CID 109342983
N-cyclohexyl-6-(prop-2-enylamino)pyrimidine-4-carboxamide
CID 109339420
N-(4-acetamidophenyl)-6-(cyclohexylamino)pyrimidine-4-carboxamide
CID 46880877
6-anilino-N-cyclopentylpyrimidine-4-carboxamide
CID 109341462
methyl 2-[[6-(cyclohexylamino)pyrimidine-4-carbonyl]amino]acetate
CID 134069591
[6-(cyclopentylamino)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109341196
6-(4-bromoanilino)-N-cyclopentylpyrimidine-4-carboxamide
CID 109341498
N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274884
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
N-(2-chlorophenyl)-6-(cyclopentylamino)pyrimidine-4-carboxamide
CID 109341303

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide (CID 109341807) is N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide is O=C(NC1CCCCC1)c1cc(NC2CCCCC2)ncn1.
What is the InChIKey of N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide?
The InChIKey is IYJWDZFWCNNKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c22-17(21-14-9-5-2-6-10-14)15-11-16(19-12-18-15)20-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,21,22)(H,18,19,20).
What are the key properties of N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide?
N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 3.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide is sourced from PubChem (CID 109341807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).