N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine

C10H19N — CID 126994828

IUPACN-methyl-N-(3-methylbut-2-enyl)cyclobutanamine
SMILESCC(C)=CCN(C)C1CCC1
InChIInChI=1S/C10H19N/c1-9(2)7-8-11(3)10-5-4-6-10/h7,10H,4-6,8H2,1-3H3
InChIKeyKXYJMDVLXLCBFO-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.44
Rot. Bonds3

About N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine

N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine (PubChem CID 126994828) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine.

Molecular Properties

Compound NameN-methyl-N-(3-methylbut-2-enyl)cyclobutanamine
PubChem CID126994828
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-methyl-N-(3-methylbut-2-enyl)cyclobutanamine
SMILESCC(C)=CCN(C)C1CCC1
InChIInChI=1S/C10H19N/c1-9(2)7-8-11(3)10-5-4-6-10/h7,10H,4-6,8H2,1-3H3
InChIKeyKXYJMDVLXLCBFO-UHFFFAOYSA-N
XLogP2.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-N,4-N-dimethyl-4-N-(3-methylbut-2-enyl)cyclohexane-1,4-diamine
CID 79110999
[4-[methyl(3-methylbut-2-enyl)amino]cyclohexyl]methanol
CID 84591910
methyl 4-[cyclohexyl(methyl)amino]-2-methylbut-2-enoate
CID 77076301
N'-cyclopentyl-N'-methyl-N-(3-methylbut-2-enyl)ethane-1,2-diamine
CID 106547137
2-[cyclopentyl(3-methylbut-2-enyl)amino]ethanol
CID 62014272
(E)-4-[cyclobutyl(methyl)amino]but-2-enoic acid
CID 71209049
2-methyl-4-[methyl-(3-methylcyclohexyl)amino]but-2-enoic acid
CID 77076199
methyl 4-[cycloheptyl(methyl)amino]-2-ethylbut-2-enoate
CID 77100982
4-[cyclobutyl(methyl)amino]but-2-enoyl chloride
CID 123830742
(E)-6-[cyclobutyl(methyl)amino]-2,2-dimethylhex-4-en-3-one
CID 140905940
methyl 2-methyl-4-[methyl(piperidin-4-yl)amino]but-2-enoate
CID 77075192
N-(2-bromoethyl)-N-(3-methylbut-2-enyl)cyclopropanamine
CID 107901105

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine?
The IUPAC name of N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine (CID 126994828) is N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine.
What is the SMILES notation for N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine?
The canonical SMILES for N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine is CC(C)=CCN(C)C1CCC1.
What is the InChIKey of N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine?
The InChIKey is KXYJMDVLXLCBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-9(2)7-8-11(3)10-5-4-6-10/h7,10H,4-6,8H2,1-3H3.
What are the key properties of N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine?
N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine has a molecular weight of 153.27 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylbut-2-enyl)cyclobutanamine is sourced from PubChem (CID 126994828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).