4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine

C10H22N2 — CID 115346236

IUPAC4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine
SMILESCN(C)CCC(N)CC1CCC1
InChIInChI=1S/C10H22N2/c1-12(2)7-6-10(11)8-9-4-3-5-9/h9-10H,3-8,11H2,1-2H3
InChIKeyIUZJVRIMBYIWPM-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.46
Rot. Bonds5

About 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine

4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine (PubChem CID 115346236) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine.

Molecular Properties

Compound Name4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine
PubChem CID115346236
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine
SMILESCN(C)CCC(N)CC1CCC1
InChIInChI=1S/C10H22N2/c1-12(2)7-6-10(11)8-9-4-3-5-9/h9-10H,3-8,11H2,1-2H3
InChIKeyIUZJVRIMBYIWPM-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-cyclopentyl-5,5-dimethylhexan-2-amine
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(2S)-1-cyclopentylbutan-2-amine
CID 58736664
1-cyclopropylpentan-2-amine
CID 64905685
4-cyclopentyl-3-N-ethyl-1-N,1-N-dimethylbutane-1,3-diamine
CID 115346595
1-cyclobutyl-5-methylsulfonylpentan-2-amine
CID 103168350
1-cyclobutyl-4-ethylhexan-2-amine
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CID 115837607

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine?
The IUPAC name of 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine (CID 115346236) is 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine.
What is the SMILES notation for 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine?
The canonical SMILES for 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine is CN(C)CCC(N)CC1CCC1.
What is the InChIKey of 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine?
The InChIKey is IUZJVRIMBYIWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-12(2)7-6-10(11)8-9-4-3-5-9/h9-10H,3-8,11H2,1-2H3.
What are the key properties of 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine?
4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine has a molecular weight of 170.30 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 4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine is sourced from PubChem (CID 115346236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).