N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine

C14H28N2 — CID 81170358

IUPACN-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine
SMILESCC(C)CN(CCC1(CN)CCC1)C1CC1
InChIInChI=1S/C14H28N2/c1-12(2)10-16(13-4-5-13)9-8-14(11-15)6-3-7-14/h12-13H,3-11,15H2,1-2H3
InChIKeyLWGJYFGVZPVQLN-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.63
Rot. Bonds7

About N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine

N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine (PubChem CID 81170358) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine
PubChem CID81170358
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine
SMILESCC(C)CN(CCC1(CN)CCC1)C1CC1
InChIInChI=1S/C14H28N2/c1-12(2)10-16(13-4-5-13)9-8-14(11-15)6-3-7-14/h12-13H,3-11,15H2,1-2H3
InChIKeyLWGJYFGVZPVQLN-UHFFFAOYSA-N
XLogP2.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-methylcyclohexanamine
CID 81169270
[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62266509
N-[2-[1-(aminomethyl)cyclohexyl]ethyl]-N-(2-methylpropyl)pentan-3-amine
CID 104678976
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine
CID 115448846
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-methylthiolan-3-amine
CID 81168855
N'-cyclopropyl-2-methyl-N'-(3-methylbutyl)propane-1,3-diamine
CID 78973832
[1-(4-methylpentyl)cyclopentyl]methanamine
CID 83169041
4-N-(2-methylpropyl)-4-N-propylcyclohexane-1,4-diamine
CID 79112208
N'-cyclopropyl-2-ethyl-N'-(2-methylpropyl)butane-1,4-diamine
CID 81080018
2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine
CID 81171568

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine?
The IUPAC name of N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine (CID 81170358) is N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine.
What is the SMILES notation for N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine?
The canonical SMILES for N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine is CC(C)CN(CCC1(CN)CCC1)C1CC1.
What is the InChIKey of N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine?
The InChIKey is LWGJYFGVZPVQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-12(2)10-16(13-4-5-13)9-8-14(11-15)6-3-7-14/h12-13H,3-11,15H2,1-2H3.
What are the key properties of N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine?
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine has a molecular weight of 224.39 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine is sourced from PubChem (CID 81170358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).