N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine

C12H22N2 — CID 115453755

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine
SMILESNCC1(CNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C12H22N2/c13-7-12(5-6-12)8-14-11(9-1-2-9)10-3-4-10/h9-11,14H,1-8,13H2
InChIKeyAPVFMZUXHKRUDW-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.50
Rot. Bonds6

About N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine

N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine (PubChem CID 115453755) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine
PubChem CID115453755
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine
SMILESNCC1(CNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C12H22N2/c13-7-12(5-6-12)8-14-11(9-1-2-9)10-3-4-10/h9-11,14H,1-8,13H2
InChIKeyAPVFMZUXHKRUDW-UHFFFAOYSA-N
XLogP1.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine 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

2-[1-[(dicyclopropylmethylamino)methyl]cyclopropyl]ethanol
CID 114750677
2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine
CID 104678804
1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine
CID 103903505
1,1-dicyclopropyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]methanamine
CID 114042125
N-[[4-(aminomethyl)oxan-4-yl]methyl]propan-2-amine
CID 115440025
1,1-di(cyclobutyl)-N-[(1-propan-2-ylcyclopropyl)methyl]methanamine
CID 112743271
1,1-dicyclopropyl-N-[(3-propylpiperidin-3-yl)methyl]methanamine
CID 63133124
N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine
CID 115453668
N-[[1-(aminomethyl)cyclohexyl]methyl]butan-2-amine
CID 115438135
[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
CID 115442703
[1-(cyclopropyloxymethyl)cyclopropyl]methanamine
CID 84762673
N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide
CID 105361881

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine (CID 115453755) is N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine is NCC1(CNC(C2CC2)C2CC2)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine?
The InChIKey is APVFMZUXHKRUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c13-7-12(5-6-12)8-14-11(9-1-2-9)10-3-4-10/h9-11,14H,1-8,13H2.
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine?
N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine has a molecular weight of 194.32 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine is sourced from PubChem (CID 115453755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).