4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine

C14H29N — CID 63243107

IUPAC4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine
SMILESCC(C)CC(C)NCC1CCC(C)CC1
InChIInChI=1S/C14H29N/c1-11(2)9-13(4)15-10-14-7-5-12(3)6-8-14/h11-15H,5-10H2,1-4H3
InChIKeyUZQUZHQALIARSO-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.84
Rot. Bonds5

About 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine

4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine (PubChem CID 63243107) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine
PubChem CID63243107
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine
SMILESCC(C)CC(C)NCC1CCC(C)CC1
InChIInChI=1S/C14H29N/c1-11(2)9-13(4)15-10-14-7-5-12(3)6-8-14/h11-15H,5-10H2,1-4H3
InChIKeyUZQUZHQALIARSO-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(4-methylpentan-2-ylamino)methyl]cyclohexan-1-ol
CID 106126383
N-[(4-methylcyclohexyl)methyl]-1-methylsulfonylpropan-2-amine
CID 64629762
N-[(4-methylcyclohexyl)methyl]nonan-2-amine
CID 63464065
ethyl 3-[(4-methylcyclohexyl)methylamino]butanoate
CID 63243710
2-(cyclopropylmethylamino)propan-1-ol
CID 43560365
4-methyl-N-(oxan-3-ylmethyl)pentan-2-amine
CID 61020127
N-[(4-ethylcyclohexyl)methyl]-2,6-dimethylheptan-4-amine
CID 63451824
N-(cyclopropylmethyl)-1-(4-methylcyclohexyl)methanamine
CID 63001385
2-methyl-3-[(4-methylcyclohexyl)methylamino]butanoic acid
CID 79398095
N-(cyclopentylmethyl)-2,6-dimethylheptan-4-amine
CID 43370762
1-(1-adamantyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 63462111
(2R)-2-[(4-propylcyclohexyl)methylamino]propan-1-ol
CID 103896927

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine?
The IUPAC name of 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine (CID 63243107) is 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine.
What is the SMILES notation for 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine?
The canonical SMILES for 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine is CC(C)CC(C)NCC1CCC(C)CC1.
What is the InChIKey of 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine?
The InChIKey is UZQUZHQALIARSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-11(2)9-13(4)15-10-14-7-5-12(3)6-8-14/h11-15H,5-10H2,1-4H3.
What are the key properties of 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine?
4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4-methylcyclohexyl)methyl]pentan-2-amine is sourced from PubChem (CID 63243107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).