N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine

C11H24N2 — CID 115448846

IUPACN-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC1(CN)CCC1
InChIInChI=1S/C11H24N2/c1-10(2)7-13(3)9-11(8-12)5-4-6-11/h10H,4-9,12H2,1-3H3
InChIKeyISSOTZRJWQDZSI-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.70
Rot. Bonds5

About N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine

N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine (PubChem CID 115448846) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine
PubChem CID115448846
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC1(CN)CCC1
InChIInChI=1S/C11H24N2/c1-10(2)7-13(3)9-11(8-12)5-4-6-11/h10H,4-9,12H2,1-3H3
InChIKeyISSOTZRJWQDZSI-UHFFFAOYSA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[3-(aminomethyl)oxan-3-yl]methyl]-N,2-dimethylpropan-1-amine
CID 63740832
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115448961
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,3-dimethylbutan-1-amine
CID 115453726
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 115453707
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,3-dimethylbutanamide
CID 115267579
2-N-[[1-(aminomethyl)cyclopentyl]methyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103189548
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-1-phenylmethanamine
CID 82171579
N-[[1-(bromomethyl)cyclobutyl]methyl]-N,2-dimethylbutan-1-amine
CID 65009362
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 63633209
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-(2-methylpropyl)cyclopropanamine
CID 81170358
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 63631821
2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(2-methylpropyl)acetamide
CID 81178763

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine (CID 115448846) is N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine is CC(C)CN(C)CC1(CN)CCC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine?
The InChIKey is ISSOTZRJWQDZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10(2)7-13(3)9-11(8-12)5-4-6-11/h10H,4-9,12H2,1-3H3.
What are the key properties of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine?
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclobutyl]methyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 115448846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).