1-(4-butylcyclohexyl)-N-methylmethanamine

C12H25N — CID 43163686

IUPAC1-(4-butylcyclohexyl)-N-methylmethanamine
SMILESCCCCC1CCC(CNC)CC1
InChIInChI=1S/C12H25N/c1-3-4-5-11-6-8-12(9-7-11)10-13-2/h11-13H,3-10H2,1-2H3
InChIKeyHYZPODNQSBDAPQ-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds5

About 1-(4-butylcyclohexyl)-N-methylmethanamine

1-(4-butylcyclohexyl)-N-methylmethanamine (PubChem CID 43163686) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)-N-methylmethanamine
PubChem CID43163686
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-(4-butylcyclohexyl)-N-methylmethanamine
SMILESCCCCC1CCC(CNC)CC1
InChIInChI=1S/C12H25N/c1-3-4-5-11-6-8-12(9-7-11)10-13-2/h11-13H,3-10H2,1-2H3
InChIKeyHYZPODNQSBDAPQ-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(4-butylcyclohexyl)methyl]ethanamine
CID 43163710
hexane;pentylcyclopropane
CID 159592467
1,4-dihexylcyclohexane
CID 22947938
1-dodecyl-4-pentadecylcyclohexane
CID 123560684
octadecane;pentadecylcyclopropane
CID 173301851
tetradecane;undecylcyclopropane
CID 173215670
azane;hexylcyclopropane
CID 135322230
1-(4-butyl-3-methylcyclohexyl)-N-methylmethanamine
CID 89010871
butylcyclohexane;N-methylmethanamine
CID 174941558
1-butyl-4-[4-(4-decylcyclohexyl)cyclohexyl]cyclohexane
CID 54137563
N-[(4-butylcyclohexyl)methyl]-2-methylpropan-1-amine
CID 63505259
1-butyl-4-ethylcyclohexane;methane
CID 145295190

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(4-butylcyclohexyl)-N-methylmethanamine (CID 43163686) is 1-(4-butylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-butylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-butylcyclohexyl)-N-methylmethanamine is CCCCC1CCC(CNC)CC1.
What is the InChIKey of 1-(4-butylcyclohexyl)-N-methylmethanamine?
The InChIKey is HYZPODNQSBDAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-3-4-5-11-6-8-12(9-7-11)10-13-2/h11-13H,3-10H2,1-2H3.
What are the key properties of 1-(4-butylcyclohexyl)-N-methylmethanamine?
1-(4-butylcyclohexyl)-N-methylmethanamine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 43163686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).