1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine

C11H23N — CID 123215051

IUPAC1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine
SMILESCCC(C)C(C)C1CC(C)(N)C1
InChIInChI=1S/C11H23N/c1-5-8(2)9(3)10-6-11(4,12)7-10/h8-10H,5-7,12H2,1-4H3
InChIKeyLODFKVOCHXDPCX-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.80
Rot. Bonds3

About 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine

1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine (PubChem CID 123215051) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine
PubChem CID123215051
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine
SMILESCCC(C)C(C)C1CC(C)(N)C1
InChIInChI=1S/C11H23N/c1-5-8(2)9(3)10-6-11(4,12)7-10/h8-10H,5-7,12H2,1-4H3
InChIKeyLODFKVOCHXDPCX-UHFFFAOYSA-N
XLogP2.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(3R)-3-methylpentan-2-yl]cyclopentane
CID 144516432
2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane
CID 91014133
(3R,4R,5R,6S)-3,6-dimethyloctane-4,5-diamine
CID 101057431
1-butan-2-yl-2-ethylcyclopropan-1-amine
CID 79332461
cis-(1R,5R)-1,3,3-trimethyl-5-propan-2-ylcyclohexan-1-amine;hydrochloride
CID 66838571
cis-(1R,3R)-1-methyl-3-propan-2-ylcyclohexan-1-amine
CID 124680458
2-(4,5-dimethylheptan-3-yl)-1,1-dimethylcyclopropane
CID 90861114
3-butoxy-1-methylcyclobutan-1-amine
CID 118087407
3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19-heptadecamethylhenicosan-2-ylcyclopropane
CID 123401956
1-cyclopropyl-3-methylpentan-2-amine
CID 64904257
2-butan-2-yl-1-methyl-3-(3-methylpentan-2-yl)cyclobutane
CID 90870897
(4R)-2,4-dimethylhexan-3-amine
CID 59252919

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine?
The IUPAC name of 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine (CID 123215051) is 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine?
The canonical SMILES for 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine is CCC(C)C(C)C1CC(C)(N)C1.
What is the InChIKey of 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine?
The InChIKey is LODFKVOCHXDPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-8(2)9(3)10-6-11(4,12)7-10/h8-10H,5-7,12H2,1-4H3.
What are the key properties of 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine?
1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 123215051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).