2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine

C13H26N2 — CID 65479951

IUPAC2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine
SMILESCC1CCCN(CC2(CCN)CC2)CC1
InChIInChI=1S/C13H26N2/c1-12-3-2-9-15(10-4-12)11-13(5-6-13)7-8-14/h12H,2-11,14H2,1H3
InChIKeyFZZBPPJGZLVTGJ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.24
Rot. Bonds4

About 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine

2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine (PubChem CID 65479951) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine
PubChem CID65479951
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine
SMILESCC1CCCN(CC2(CCN)CC2)CC1
InChIInChI=1S/C13H26N2/c1-12-3-2-9-15(10-4-12)11-13(5-6-13)7-8-14/h12H,2-11,14H2,1H3
InChIKeyFZZBPPJGZLVTGJ-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine 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

N'-hydroxy-2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanimidamide
CID 77071646
1-[(4-methylazepan-1-yl)methyl]cyclohexan-1-amine
CID 63625982
1-[(1-fluorocyclopropyl)methyl]-4-methylazepane
CID 130667715
[1-[(4-methylpiperidin-1-yl)methyl]cyclopropyl]methanol
CID 82111584
4-methyl-1-[(3-propylpiperidin-3-yl)methyl]azepane
CID 55247480
1-[(4-methylazepan-1-yl)methyl]cyclopentane-1-carboxylic acid
CID 63622664
N-[[3-[(4-methylazepan-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55249798
1-[(4-methylpiperidin-1-yl)methyl]cyclobutan-1-ol
CID 115692712
(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine
CID 167196358
1-[[1-(2-aminoethyl)cyclopropyl]methyl]-3-methylpyrrolidin-3-ol
CID 103355608
2-[1-[(3-methylpiperidin-1-yl)methyl]cyclopropyl]acetonitrile
CID 65495067
1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
CID 63129487

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine?
The IUPAC name of 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine (CID 65479951) is 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine is CC1CCCN(CC2(CCN)CC2)CC1.
What is the InChIKey of 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine?
The InChIKey is FZZBPPJGZLVTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-12-3-2-9-15(10-4-12)11-13(5-6-13)7-8-14/h12H,2-11,14H2,1H3.
What are the key properties of 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine?
2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine has a molecular weight of 210.36 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine is sourced from PubChem (CID 65479951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).