N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide

C10H19NO — CID 88958031

IUPACN-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide
SMILESCC(C)[C@H]1CCCC[C@H]1NC=O
InChIInChI=1S/C10H19NO/c1-8(2)9-5-3-4-6-10(9)11-7-12/h7-10H,3-6H2,1-2H3,(H,11,12)/t9-,10-/m1/s1
InChIKeyCJBCQDVDHZYIQA-NXEZZACHSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds3

About N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide

N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide (PubChem CID 88958031) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide
PubChem CID88958031
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide
SMILESCC(C)[C@H]1CCCC[C@H]1NC=O
InChIInChI=1S/C10H19NO/c1-8(2)9-5-3-4-6-10(9)11-7-12/h7-10H,3-6H2,1-2H3,(H,11,12)/t9-,10-/m1/s1
InChIKeyCJBCQDVDHZYIQA-NXEZZACHSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]formamide
CID 59847881
trans-(1R,2S)-2-propan-2-yl-N-[(1S,2S)-2-propan-2-ylcyclohexyl]cyclohexan-1-amine
CID 124709501
N-fluoro-2-propan-2-ylcyclohexan-1-amine
CID 142212218
N,2-di(propan-2-yl)cycloheptan-1-amine
CID 164647627
N-(2-tert-butylcyclohexyl)formamide
CID 64990782
(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine
CID 90381453
N-(2-methylpropyl)-2-propan-2-ylcyclohexan-1-amine
CID 81301790
N-[(1S,2S)-2-hydroxycyclopentyl]formamide
CID 57089664
N-(methylsulfonimidoyl)-2-propan-2-ylcyclohexan-1-amine
CID 164644373
N-(2-propan-2-ylcyclohexyl)ethanesulfonamide
CID 59292409
N-(3-methylbut-2-enyl)-2-propan-2-ylcyclohexan-1-amine
CID 107900207
2-propan-2-yl-N-propylcyclohexan-1-amine
CID 62603110

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide?
The IUPAC name of N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide (CID 88958031) is N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide.
What is the SMILES notation for N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide?
The canonical SMILES for N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide is CC(C)[C@H]1CCCC[C@H]1NC=O.
What is the InChIKey of N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide?
The InChIKey is CJBCQDVDHZYIQA-NXEZZACHSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(2)9-5-3-4-6-10(9)11-7-12/h7-10H,3-6H2,1-2H3,(H,11,12)/t9-,10-/m1/s1.
What are the key properties of N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide?
N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide has a molecular weight of 169.27 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-propan-2-ylcyclohexyl]formamide is sourced from PubChem (CID 88958031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).