N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine

C11H24N2 — CID 80544292

IUPACN-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine
SMILESCC(CCN)CN(C)CC1CCC1
InChIInChI=1S/C11H24N2/c1-10(6-7-12)8-13(2)9-11-4-3-5-11/h10-11H,3-9,12H2,1-2H3
InChIKeyLPBXRZUEIOVAAD-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.70
Rot. Bonds6

About N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine

N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine (PubChem CID 80544292) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine
PubChem CID80544292
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine
SMILESCC(CCN)CN(C)CC1CCC1
InChIInChI=1S/C11H24N2/c1-10(6-7-12)8-13(2)9-11-4-3-5-11/h10-11H,3-9,12H2,1-2H3
InChIKeyLPBXRZUEIOVAAD-UHFFFAOYSA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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

3-bromo-N-(cyclobutylmethyl)-N,2-dimethylpropan-1-amine
CID 64994702
N-cycloheptyl-N,2-dimethylbutane-1,4-diamine
CID 80544341
3-N-(cyclopentylmethyl)-3-N-methylpropane-1,2,3-triamine
CID 115119915
3-amino-4-[cyclopentylmethyl(methyl)amino]butan-1-ol
CID 64897715
N,2-dimethyl-N-(oxan-2-ylmethyl)pentane-1,5-diamine
CID 104681987
2-amino-3-[cyclobutylmethyl(methyl)amino]propan-1-ol
CID 64787802
N',2-dimethyl-N'-[(1-methylpyrrolidin-3-yl)methyl]propane-1,3-diamine
CID 63275885
(2S)-1-N-(cyclopropylmethyl)-1-N-methylpropane-1,2-diamine
CID 93424361
1-N-(cyclopropylmethyl)-1-N-methylpropane-1,2-diamine
CID 60984207
N'-(cyclopentylmethyl)-N'-methylethane-1,2-diamine
CID 55151127
N,2-dimethyl-N-(piperidin-3-ylmethyl)pentan-1-amine
CID 106623913
N-tert-butyl-N'-(cyclopentylmethyl)-N',2-dimethylpropane-1,3-diamine
CID 63656930

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine?
The IUPAC name of N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine (CID 80544292) is N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine.
What is the SMILES notation for N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine?
The canonical SMILES for N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine is CC(CCN)CN(C)CC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine?
The InChIKey is LPBXRZUEIOVAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10(6-7-12)8-13(2)9-11-4-3-5-11/h10-11H,3-9,12H2,1-2H3.
What are the key properties of N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine?
N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N,2-dimethylbutane-1,4-diamine is sourced from PubChem (CID 80544292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).