N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine

C11H22N2 — CID 115453668

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine
SMILESCC(C1CC1)N(C)CC1(CN)CC1
InChIInChI=1S/C11H22N2/c1-9(10-3-4-10)13(2)8-11(7-12)5-6-11/h9-10H,3-8,12H2,1-2H3
InChIKeyIZNJESHLXWUJIA-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.46
Rot. Bonds5

About N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine

N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine (PubChem CID 115453668) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine
PubChem CID115453668
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine
SMILESCC(C1CC1)N(C)CC1(CN)CC1
InChIInChI=1S/C11H22N2/c1-9(10-3-4-10)13(2)8-11(7-12)5-6-11/h9-10H,3-8,12H2,1-2H3
InChIKeyIZNJESHLXWUJIA-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]ethanamine
CID 62391484
1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine
CID 63133014
N'-(1-cyclopropylethyl)-N',2-dimethylpropane-1,3-diamine
CID 43568827
N-[[4-[[1-cyclopropylethyl(methyl)amino]methyl]oxan-4-yl]methyl]-2-methylpropan-1-amine
CID 62391307
1-cyclopropyl-N-ethyl-N-methylethanamine
CID 126664134
N-(1-cyclopropylethyl)-N,2,2-trimethylpropan-1-amine
CID 77360899
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,3-dimethylbutan-1-amine
CID 115453726
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylethyl)-N-methylacetamide
CID 104677614
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 115453707
1-(aminomethyl)-N-(1-cyclopropylethyl)-N,3-dimethylcyclohexan-1-amine
CID 43568986
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methylcyclobutanesulfonamide
CID 115272617
(2S)-1-[1-cyclopropylethyl(methyl)amino]propan-2-ol
CID 103934958

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine (CID 115453668) is N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine is CC(C1CC1)N(C)CC1(CN)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine?
The InChIKey is IZNJESHLXWUJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(10-3-4-10)13(2)8-11(7-12)5-6-11/h9-10H,3-8,12H2,1-2H3.
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine?
N-[[1-(aminomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylethanamine has a molecular weight of 182.31 g/mol, XLogP of 1.46, 5 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]-1-cyclopropyl-N-methylethanamine is sourced from PubChem (CID 115453668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).