1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide

C15H28N2O — CID 54891380

IUPAC1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCC1CCC(C(C)C)C(NCC2CC2)(C(N)=O)C1
InChIInChI=1S/C15H28N2O/c1-10(2)13-7-4-11(3)8-15(13,14(16)18)17-9-12-5-6-12/h10-13,17H,4-9H2,1-3H3,(H2,16,18)
InChIKeyGHXWGMGCIADPOL-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.30
Rot. Bonds5

About 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide

1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide (PubChem CID 54891380) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
PubChem CID54891380
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCC1CCC(C(C)C)C(NCC2CC2)(C(N)=O)C1
InChIInChI=1S/C15H28N2O/c1-10(2)13-7-4-11(3)8-15(13,14(16)18)17-9-12-5-6-12/h10-13,17H,4-9H2,1-3H3,(H2,16,18)
InChIKeyGHXWGMGCIADPOL-UHFFFAOYSA-N
XLogP2.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide (CID 54891380) is 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide is CC1CCC(C(C)C)C(NCC2CC2)(C(N)=O)C1.
What is the InChIKey of 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The InChIKey is GHXWGMGCIADPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-10(2)13-7-4-11(3)8-15(13,14(16)18)17-9-12-5-6-12/h10-13,17H,4-9H2,1-3H3,(H2,16,18).
What are the key properties of 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 54891380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).