2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide

C11H16N4O2 — CID 57382287

IUPAC2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide
SMILESO=C(NO)c1cnc(NC2CCCCC2)nc1
InChIInChI=1S/C11H16N4O2/c16-10(15-17)8-6-12-11(13-7-8)14-9-4-2-1-3-5-9/h6-7,9,17H,1-5H2,(H,15,16)(H,12,13,14)
InChIKeyRJXGNFOJIHGPSK-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.34
Rot. Bonds3

About 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide

2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide (PubChem CID 57382287) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide
PubChem CID57382287
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide
SMILESO=C(NO)c1cnc(NC2CCCCC2)nc1
InChIInChI=1S/C11H16N4O2/c16-10(15-17)8-6-12-11(13-7-8)14-9-4-2-1-3-5-9/h6-7,9,17H,1-5H2,(H,15,16)(H,12,13,14)
InChIKeyRJXGNFOJIHGPSK-UHFFFAOYSA-N
XLogP1.34
TPSA87.14 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-Amino-2-(cyclopentylamino)pyrimidine-5-carboxamide
CID 70694174
2-[(4-Methoxycyclohexyl)amino]-4-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 71238006
2-amino-N-hydroxypyrimidine-5-carboxamide
CID 87814574
2-[3-(2-methylpiperidin-1-yl)propylamino]-N-(2-methylpropyl)-4-(2-methylpropylamino)pyrimidine-5-carboxamide
CID 45489239
2-[(1S,5R)-6-(cyclohexylmethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-N-hydroxypyrimidine-5-carboxamide
CID 49856929
Pyrimidine, 5-carbamoyl-2-methylamino-
CID 69179728
N-hydroxy-2-(oxan-4-ylamino)pyrimidine-5-carboxamide
CID 57382071
US8609678, N-(7-(hydroxyamino)-7-oxoheptyl)-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide [188]
CID 87356065
US8609678, N-(7-(hydroxyamino)-7-oxoheptyl)-2-(piperidin-1-yl)pyrimidine-5-carboxamide [187]
CID 87356117
US8609678, N-(7-(hydroxyamino)-7-oxoheptyl)-2-(piperazin-1-yl)pyrimidine-5-carboxamide [168]
CID 87356244
US8609678, 2-(1,4-diazepan-1-yl)-N-(7-(hydroxyamino)-7-oxoheptyl)pyrimidine-5-carboxamide [186]
CID 87365548
2-(1-adamantylamino)-N-hydroxypyrimidine-5-carboxamide
CID 87718111

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide?
The IUPAC name of 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide (CID 57382287) is 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide.
What is the SMILES notation for 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide?
The canonical SMILES for 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide is O=C(NO)c1cnc(NC2CCCCC2)nc1.
What is the InChIKey of 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide?
The InChIKey is RJXGNFOJIHGPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c16-10(15-17)8-6-12-11(13-7-8)14-9-4-2-1-3-5-9/h6-7,9,17H,1-5H2,(H,15,16)(H,12,13,14).
What are the key properties of 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide?
2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-N-hydroxypyrimidine-5-carboxamide is sourced from PubChem (CID 57382287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).