N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide

C16H30N2O — CID 119404631

IUPACN-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide
SMILESNC1(CNC(=O)C2CCCCCCC2)CCCCC1
InChIInChI=1S/C16H30N2O/c17-16(11-7-4-8-12-16)13-18-15(19)14-9-5-2-1-3-6-10-14/h14H,1-13,17H2,(H,18,19)
InChIKeyWWJNOLPMDSLYDX-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.12
Rot. Bonds3

About N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide

N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide (PubChem CID 119404631) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide.

Molecular Properties

Compound NameN-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide
PubChem CID119404631
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide
SMILESNC1(CNC(=O)C2CCCCCCC2)CCCCC1
InChIInChI=1S/C16H30N2O/c17-16(11-7-4-8-12-16)13-18-15(19)14-9-5-2-1-3-6-10-14/h14H,1-13,17H2,(H,18,19)
InChIKeyWWJNOLPMDSLYDX-UHFFFAOYSA-N
XLogP3.12
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-aminocyclohexyl)methyl]cycloheptanecarboxamide
CID 119404597
N-[(1-aminocyclopentyl)methyl]cyclobutanecarboxamide
CID 164661339
N-[(1-hydroxycyclohexyl)methyl]cycloheptanecarboxamide
CID 65114198
N-[[1-(hydroxymethyl)cyclopropyl]methyl]cyclooctanecarboxamide
CID 80717782
N-[(1-aminocyclohexyl)methyl]bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119404189
1-[(cyclohexanecarbonylamino)methyl]cyclohexane-1-carboxylic acid
CID 69400249
ethane;formaldehyde;N-[(1-methylcyclohexyl)methyl]cyclohexanecarboxamide
CID 90789963
(1-aminocyclohexyl)methylurea
CID 61298669
2-[1-[(cyclohexanecarbonylamino)methyl]cyclobutyl]acetic acid
CID 81164623
2-[1-[(cycloheptanecarbonylamino)methyl]cyclobutyl]acetic acid
CID 81164488
N-[(1-aminocyclohexyl)methyl]tricyclo[3.2.1.02,4]octane-3-carboxamide;hydrochloride
CID 119404440
N-[(1-aminocycloheptyl)methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide;hydrochloride
CID 154578163

Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide?
The IUPAC name of N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide (CID 119404631) is N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide.
What is the SMILES notation for N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide?
The canonical SMILES for N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide is NC1(CNC(=O)C2CCCCCCC2)CCCCC1.
What is the InChIKey of N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide?
The InChIKey is WWJNOLPMDSLYDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c17-16(11-7-4-8-12-16)13-18-15(19)14-9-5-2-1-3-6-10-14/h14H,1-13,17H2,(H,18,19).
What are the key properties of N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide?
N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide has a molecular weight of 266.43 g/mol, XLogP of 3.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclohexyl)methyl]cyclooctanecarboxamide is sourced from PubChem (CID 119404631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).