N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

C13H28N2 — CID 115453707

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CN(CC(C)C)CC1(CN)CC1
InChIInChI=1S/C13H28N2/c1-11(2)7-15(8-12(3)4)10-13(9-14)5-6-13/h11-12H,5-10,14H2,1-4H3
InChIKeyMSXKKMAQQGGZIP-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.34
Rot. Bonds7

About N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (PubChem CID 115453707) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
PubChem CID115453707
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CN(CC(C)C)CC1(CN)CC1
InChIInChI=1S/C13H28N2/c1-11(2)7-15(8-12(3)4)10-13(9-14)5-6-13/h11-12H,5-10,14H2,1-4H3
InChIKeyMSXKKMAQQGGZIP-UHFFFAOYSA-N
XLogP2.34
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-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

N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine
CID 115448846
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,3-dimethylbutan-1-amine
CID 115453726
2-[1-[[bis(2-methylpropyl)amino]methyl]cyclopropyl]ethanethioamide
CID 65495325
[1-[[bis(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62270231
2-[[1-(2-aminoethyl)cyclopropyl]methyl-(2-methylpropyl)amino]acetamide
CID 65480537
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115448961
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 81171349
N'-[[1-(aminomethyl)cyclopropyl]methyl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 102994374
N-[[1-(aminomethyl)cyclopentyl]methyl]-N-ethylethanamine
CID 62262051
N-[[1-(ethylaminomethyl)cyclopentyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 63493661
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 82954753
N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine
CID 115453668

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (CID 115453707) is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is CC(C)CN(CC(C)C)CC1(CN)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The InChIKey is MSXKKMAQQGGZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(2)7-15(8-12(3)4)10-13(9-14)5-6-13/h11-12H,5-10,14H2,1-4H3.
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 115453707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).