2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide

C15H26N2O — CID 64824095

IUPAC2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCCC1=CCCCC1
InChIInChI=1S/C15H26N2O/c16-14-9-5-4-8-13(14)15(18)17-11-10-12-6-2-1-3-7-12/h6,13-14H,1-5,7-11,16H2,(H,17,18)
InChIKeyQCXBKUVVBWZBTC-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.51
Rot. Bonds4

About 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide

2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide (PubChem CID 64824095) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide
PubChem CID64824095
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCCC1=CCCCC1
InChIInChI=1S/C15H26N2O/c16-14-9-5-4-8-13(14)15(18)17-11-10-12-6-2-1-3-7-12/h6,13-14H,1-5,7-11,16H2,(H,17,18)
InChIKeyQCXBKUVVBWZBTC-UHFFFAOYSA-N
XLogP2.51
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 162644302
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CID 206764
(Z)-N-(4-methylcyclohexyl)octadec-9-enamide
CID 168296804
N-[2-(1-cyclohexen-1-yl)ethyl]-2-cyclohexylacetamide
CID 848109
N-[2-(cyclohexen-1-yl)ethyl]cyclohexanecarboxamide
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CID 122136654
N,N-methylcyclohexyl linoleamide
CID 129716698
(2-aminocyclohexyl)-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 114489813
N-(2-methylcyclohexyl)cyclohex-3-ene-1-carboxamide
CID 45858566
N-[2-(1-but-3-en-1-yl-1,2,3,6-tetrahydropyridin-4-yl)ethyl]cyclohexanecarboxamide
CID 50963980
N-[(1-cyclohex-2-en-1-yl-1,2,5,6-tetrahydropyridin-3-yl)methyl]-3-cyclopentylpropanamide
CID 50977214
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CID 83278369

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide (CID 64824095) is 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide is NC1CCCCC1C(=O)NCCC1=CCCCC1.
What is the InChIKey of 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide?
The InChIKey is QCXBKUVVBWZBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c16-14-9-5-4-8-13(14)15(18)17-11-10-12-6-2-1-3-7-12/h6,13-14H,1-5,7-11,16H2,(H,17,18).
What are the key properties of 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide?
2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 64824095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).