1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide

C14H26N2O — CID 112682408

IUPAC1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide
SMILESCC1(C)CC(C)(C)CC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H26N2O/c1-12(2)7-13(3,4)9-14(8-12,11(15)17)16-10-5-6-10/h10,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyXZOLNBZPYFRMEX-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.20
Rot. Bonds3

About 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide

1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide (PubChem CID 112682408) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide
PubChem CID112682408
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide
SMILESCC1(C)CC(C)(C)CC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H26N2O/c1-12(2)7-13(3,4)9-14(8-12,11(15)17)16-10-5-6-10/h10,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyXZOLNBZPYFRMEX-UHFFFAOYSA-N
XLogP2.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cycloheptylamino)-3,3-dimethylcyclopentane-1-carboxamide
CID 80706275
methyl 1-(cyclohexylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxylate
CID 115999242
1-(cyclopropylamino)cyclooctane-1-carboxamide
CID 60795922
1-(cyclopropylamino)-3-methylcyclopentane-1-carboxamide
CID 64513100
1-(cyclopentylamino)cyclopropane-1-carboxamide
CID 103950092
1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide
CID 61002718
8-(cyclopropylamino)-1,4-dioxaspiro[4.5]decane-8-carboxamide
CID 54891087
3-(cyclohexylamino)thietane-3-carboxamide
CID 131124021
1-(oxan-4-ylamino)cyclopropane-1-carboxamide
CID 127007956
4-(cyclopropylamino)-1-propylpiperidine-4-carboxamide
CID 60796952
1-(cyclopentylamino)-3-methoxycyclobutane-1-carboxamide
CID 106822486
3-(cycloheptylamino)azetidine-3-carboxamide
CID 79307545

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide (CID 112682408) is 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide is CC1(C)CC(C)(C)CC(NC2CC2)(C(N)=O)C1.
What is the InChIKey of 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide?
The InChIKey is XZOLNBZPYFRMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12(2)7-13(3,4)9-14(8-12,11(15)17)16-10-5-6-10/h10,16H,5-9H2,1-4H3,(H2,15,17).
What are the key properties of 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide?
1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide is sourced from PubChem (CID 112682408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).