1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine

C17H25N — CID 114602754

IUPAC1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine
SMILESCNC(c1cccc(C2CCC2)c1)C1CCCC1
InChIInChI=1S/C17H25N/c1-18-17(14-6-2-3-7-14)16-11-5-10-15(12-16)13-8-4-9-13/h5,10-14,17-18H,2-4,6-9H2,1H3
InChIKeyYSGJJAOHDCCMOG-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.40
Rot. Bonds4

About 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine

1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine (PubChem CID 114602754) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine
PubChem CID114602754
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine
SMILESCNC(c1cccc(C2CCC2)c1)C1CCCC1
InChIInChI=1S/C17H25N/c1-18-17(14-6-2-3-7-14)16-11-5-10-15(12-16)13-8-4-9-13/h5,10-14,17-18H,2-4,6-9H2,1H3
InChIKeyYSGJJAOHDCCMOG-UHFFFAOYSA-N
XLogP4.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-cyclobutylphenyl)-N-methyl-1-(5-methyloxolan-3-yl)methanamine
CID 105053875
N-[(3-cyclobutylphenyl)-cyclohexylmethyl]propan-1-amine
CID 114602717
1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
CID 65399402
1-cyclohexyl-N-methyl-1-(3-methylphenyl)methanamine
CID 60818000
1-cyclohexyl-1-(4-cyclohexylphenyl)-N-methylmethanamine
CID 43484996
1-(3-chlorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 65400043
1-(4-cyclobutylphenyl)-1-cyclopropyl-N-methylmethanamine
CID 116505983
3-[cyclobutyl(methylamino)methyl]benzoic acid
CID 116953914
1-cycloheptyl-N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine
CID 65399168
1-(3-cyclobutylphenyl)-2-methoxy-N-methylethanamine
CID 114602794
(3-cyclobutylphenyl)-cyclopropylmethanol
CID 114601273
1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine
CID 114602608

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine?
The IUPAC name of 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine (CID 114602754) is 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine.
What is the SMILES notation for 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine?
The canonical SMILES for 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine is CNC(c1cccc(C2CCC2)c1)C1CCCC1.
What is the InChIKey of 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine?
The InChIKey is YSGJJAOHDCCMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-18-17(14-6-2-3-7-14)16-11-5-10-15(12-16)13-8-4-9-13/h5,10-14,17-18H,2-4,6-9H2,1H3.
What are the key properties of 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine?
1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine has a molecular weight of 243.39 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine is sourced from PubChem (CID 114602754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).