3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine

C15H29N — CID 103966203

IUPAC3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine
SMILESC=C(CC)CNC1CC(C)(C)CC(C)(C)C1
InChIInChI=1S/C15H29N/c1-7-12(2)10-16-13-8-14(3,4)11-15(5,6)9-13/h13,16H,2,7-11H2,1,3-6H3
InChIKeyNNPNPJCOELMVDK-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.15
Rot. Bonds4

About 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine

3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine (PubChem CID 103966203) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine
PubChem CID103966203
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine
SMILESC=C(CC)CNC1CC(C)(C)CC(C)(C)C1
InChIInChI=1S/C15H29N/c1-7-12(2)10-16-13-8-14(3,4)11-15(5,6)9-13/h13,16H,2,7-11H2,1,3-6H3
InChIKeyNNPNPJCOELMVDK-UHFFFAOYSA-N
XLogP4.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,3,3,5,5-pentamethyl-N-prop-2-enylcyclohexan-1-amine
CID 10192663
(2S)-2-(3,3-dimethylbut-1-en-2-yl)piperidine
CID 58274636
4,4-dimethyl-N-prop-2-enylcyclohexan-1-amine
CID 64418633
N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine
CID 89217463
4-ethyl-4-methyl-3-methylidene-N-propan-2-ylhexan-2-amine
CID 91412540
N-butyl-4-ethyl-4-methyl-3-methylidenehexan-2-amine
CID 91561482
3,3,5-trimethyl-N-prop-2-enyl-5-[(prop-2-enylamino)methyl]cyclohexan-1-amine
CID 121433376
3,3,5-trimethyl-5-(methylaminomethyl)-N-(2-methylcycloprop-2-en-1-yl)cyclohexan-1-amine
CID 126746316
N-[1-(3-methyl-5-methylidenecyclohexyl)ethyl]butan-2-amine
CID 130194927
2-methyl-3-methylidene-N-propan-2-yl-2-propylpentan-1-amine
CID 137428863
2-methyl-N-[1-(3-methyl-5-methylidenecyclohexyl)ethyl]propan-2-amine
CID 139319896
N-cyclohexyl-2,2-dimethyl-4-methylidenecyclohexan-1-amine
CID 140408507

Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine?
The IUPAC name of 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine (CID 103966203) is 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine.
What is the SMILES notation for 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine?
The canonical SMILES for 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine is C=C(CC)CNC1CC(C)(C)CC(C)(C)C1.
What is the InChIKey of 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine?
The InChIKey is NNPNPJCOELMVDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-7-12(2)10-16-13-8-14(3,4)11-15(5,6)9-13/h13,16H,2,7-11H2,1,3-6H3.
What are the key properties of 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine?
3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine is sourced from PubChem (CID 103966203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).