2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine

C12H25N — CID 65196170

IUPAC2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine
SMILESCCCC1(CNCC(C)C)CCC1
InChIInChI=1S/C12H25N/c1-4-6-12(7-5-8-12)10-13-9-11(2)3/h11,13H,4-10H2,1-3H3
InChIKeyYLHRWBDKUYHMLW-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds6

About 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine

2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine (PubChem CID 65196170) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine
PubChem CID65196170
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine
SMILESCCCC1(CNCC(C)C)CCC1
InChIInChI=1S/C12H25N/c1-4-6-12(7-5-8-12)10-13-9-11(2)3/h11,13H,4-10H2,1-3H3
InChIKeyYLHRWBDKUYHMLW-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[1-(aminomethyl)cycloheptyl]methyl]-2-methylpropan-1-amine
CID 115444997
N-[[1-(ethoxymethyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 103984513
N-[[1-(3-ethylsulfonylpropyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 65097230
N-[[1-[(5-ethylthiophen-2-yl)methyl]cyclobutyl]methyl]-2-methylpropan-1-amine
CID 65196618
N-[[1-(cyclopentylmethyl)cyclobutyl]methyl]-2-methylpropan-1-amine
CID 65196171
2-methyl-N-[[1-(1,3-thiazol-5-ylmethyl)cyclopentyl]methyl]propan-1-amine
CID 112644091
2-methyl-N-[(1-methylcyclobutyl)methyl]propan-1-amine
CID 65196169
N-[[1-[(4-chlorophenyl)methyl]cyclobutyl]methyl]-2-methylpropan-1-amine
CID 65196271
2-methyl-N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]propan-1-amine
CID 65166397
2-methyl-N-[[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methyl]propan-1-amine
CID 107053273
N,2-dimethyl-N-[[1-[(2-methylpropylamino)methyl]cyclopentyl]methyl]butan-2-amine
CID 63964071
2-methyl-N-[[1-[2-(trifluoromethylsulfanyl)ethyl]cyclopropyl]methyl]propan-1-amine
CID 116617806

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine (CID 65196170) is 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine is CCCC1(CNCC(C)C)CCC1.
What is the InChIKey of 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine?
The InChIKey is YLHRWBDKUYHMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-4-6-12(7-5-8-12)10-13-9-11(2)3/h11,13H,4-10H2,1-3H3.
What are the key properties of 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine?
2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine is sourced from PubChem (CID 65196170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).