1-cyclobutyl-N-methylnonan-2-amine

C14H29N — CID 115863864

IUPAC1-cyclobutyl-N-methylnonan-2-amine
SMILESCCCCCCCC(CC1CCC1)NC
InChIInChI=1S/C14H29N/c1-3-4-5-6-7-11-14(15-2)12-13-9-8-10-13/h13-15H,3-12H2,1-2H3
InChIKeyNDSJAEWFBFVBMA-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.13
Rot. Bonds9

About 1-cyclobutyl-N-methylnonan-2-amine

1-cyclobutyl-N-methylnonan-2-amine (PubChem CID 115863864) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 1-cyclobutyl-N-methylnonan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-N-methylnonan-2-amine
PubChem CID115863864
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name1-cyclobutyl-N-methylnonan-2-amine
SMILESCCCCCCCC(CC1CCC1)NC
InChIInChI=1S/C14H29N/c1-3-4-5-6-7-11-14(15-2)12-13-9-8-10-13/h13-15H,3-12H2,1-2H3
InChIKeyNDSJAEWFBFVBMA-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-cyclobutyl-N-methylnonan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclohexyl-N-methylheptan-2-amine
CID 115836969
1-cycloheptyl-N-methylhexan-2-amine
CID 115832695
1-cyclopropyloctan-2-ylhydrazine
CID 105254153
1-cyclopentylheptan-2-ylhydrazine
CID 105294676
1-cyclobutyl-5-ethoxy-N-methylpentan-2-amine
CID 105151604
1-cyclopentyl-N-propyldodecan-2-amine
CID 115845917
1-cyclohexyl-N-ethylheptan-2-amine
CID 115837188
N-methyl-1-(oxan-4-yl)hexan-2-amine
CID 79404472
1-cyclopropyl-N-ethyltridecan-2-amine
CID 104986536
1-cyclopropyl-N-methyltetradecan-3-amine
CID 104995022
N-methylundecan-4-amine
CID 60996531
N-methyl-1-(oxolan-2-yl)decan-2-amine
CID 62600553

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-methylnonan-2-amine?
The IUPAC name of 1-cyclobutyl-N-methylnonan-2-amine (CID 115863864) is 1-cyclobutyl-N-methylnonan-2-amine.
What is the SMILES notation for 1-cyclobutyl-N-methylnonan-2-amine?
The canonical SMILES for 1-cyclobutyl-N-methylnonan-2-amine is CCCCCCCC(CC1CCC1)NC.
What is the InChIKey of 1-cyclobutyl-N-methylnonan-2-amine?
The InChIKey is NDSJAEWFBFVBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-3-4-5-6-7-11-14(15-2)12-13-9-8-10-13/h13-15H,3-12H2,1-2H3.
What are the key properties of 1-cyclobutyl-N-methylnonan-2-amine?
1-cyclobutyl-N-methylnonan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 4.13, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-methylnonan-2-amine is sourced from PubChem (CID 115863864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).