4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine

C14H30N2 — CID 62414508

IUPAC4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine
SMILESCC(C)CCCNCCC1CCCCN1C
InChIInChI=1S/C14H30N2/c1-13(2)7-6-10-15-11-9-14-8-4-5-12-16(14)3/h13-15H,4-12H2,1-3H3
InChIKeyRJKVDYARRDMJBI-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.89
Rot. Bonds7

About 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine

4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine (PubChem CID 62414508) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine
PubChem CID62414508
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine
SMILESCC(C)CCCNCCC1CCCCN1C
InChIInChI=1S/C14H30N2/c1-13(2)7-6-10-15-11-9-14-8-4-5-12-16(14)3/h13-15H,4-12H2,1-3H3
InChIKeyRJKVDYARRDMJBI-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-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

7-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]octan-1-amine
CID 103604979
3-bromo-N-[2-(1-methylpiperidin-2-yl)ethyl]propan-1-amine
CID 107913859
4-iodo-N-[2-(1-methylpiperidin-2-yl)ethyl]butan-1-amine
CID 107914068
N'-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-N'-propan-2-ylbutane-1,4-diamine
CID 62414712
2-(1-methylpiperidin-2-yl)-N-(2-propan-2-yloxyethyl)ethanamine
CID 104760185
N-ethyl-2-(1-methylpiperidin-2-yl)ethanamine
CID 60685781
2,3-dimethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]butan-1-amine
CID 64570931
N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine
CID 62575588
3-chloro-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine
CID 107913946
2-chloro-3-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]butan-1-amine
CID 107913930
N-[2-(1-methylpyrrolidin-2-yl)ethyl]octan-1-amine
CID 166754142
N-[2-(1-methylpiperidin-2-yl)ethyl]-2-piperidin-1-ylpropan-1-amine
CID 55067071

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine?
The IUPAC name of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine (CID 62414508) is 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine.
What is the SMILES notation for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine?
The canonical SMILES for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine is CC(C)CCCNCCC1CCCCN1C.
What is the InChIKey of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine?
The InChIKey is RJKVDYARRDMJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-13(2)7-6-10-15-11-9-14-8-4-5-12-16(14)3/h13-15H,4-12H2,1-3H3.
What are the key properties of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine?
4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine is sourced from PubChem (CID 62414508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).