N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine

C16H31N — CID 114207759

IUPACN-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCC1(C)C(NCC2CCCCCCC2)C1(C)C
InChIInChI=1S/C16H31N/c1-15(2)14(16(15,3)4)17-12-13-10-8-6-5-7-9-11-13/h13-14,17H,5-12H2,1-4H3
InChIKeyKBFMVBNJKGAQJV-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.37
Rot. Bonds3

About N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine

N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine (PubChem CID 114207759) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
PubChem CID114207759
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC NameN-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCC1(C)C(NCC2CCCCCCC2)C1(C)C
InChIInChI=1S/C16H31N/c1-15(2)14(16(15,3)4)17-12-13-10-8-6-5-7-9-11-13/h13-14,17H,5-12H2,1-4H3
InChIKeyKBFMVBNJKGAQJV-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine
CID 79350834
3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine
CID 79350836
N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine
CID 61223759
N-(cyclooctylmethyl)-2,2-dimethylcyclopentan-1-amine
CID 114207760
N-(cycloheptylmethyl)-2,2-dimethylcyclohexan-1-amine
CID 79860846
N-(cyclohexylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 43182326
N-(cyclobutylmethyl)cycloheptanamine
CID 43298514
N-(cyclopentylmethyl)-4,4-dimethylcycloheptan-1-amine
CID 65084515
N-(cyclohexylmethyl)cyclohexanamine;ethene
CID 143308482
N-(cyclohexylmethyl)bicyclo[3.1.0]hexan-6-amine
CID 131176637
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cycloheptanamine
CID 66475934
N-(cyclopentylmethyl)-2,6-dimethylcyclohexan-1-amine
CID 43370923

Frequently Asked Questions

What is the IUPAC name of N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The IUPAC name of N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine (CID 114207759) is N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine.
What is the SMILES notation for N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The canonical SMILES for N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine is CC1(C)C(NCC2CCCCCCC2)C1(C)C.
What is the InChIKey of N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The InChIKey is KBFMVBNJKGAQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-15(2)14(16(15,3)4)17-12-13-10-8-6-5-7-9-11-13/h13-14,17H,5-12H2,1-4H3.
What are the key properties of N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine is sourced from PubChem (CID 114207759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).