N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine

C16H26N2 — CID 62610042

IUPACN-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine
SMILESCNC1CCCC1CN(C)Cc1cccc(C)c1
InChIInChI=1S/C16H26N2/c1-13-6-4-7-14(10-13)11-18(3)12-15-8-5-9-16(15)17-2/h4,6-7,10,15-17H,5,8-9,11-12H2,1-3H3
InChIKeyQXWHOHJCVCXFHE-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.81
Rot. Bonds5

About N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine

N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine (PubChem CID 62610042) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine
PubChem CID62610042
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine
SMILESCNC1CCCC1CN(C)Cc1cccc(C)c1
InChIInChI=1S/C16H26N2/c1-13-6-4-7-14(10-13)11-18(3)12-15-8-5-9-16(15)17-2/h4,6-7,10,15-17H,5,8-9,11-12H2,1-3H3
InChIKeyQXWHOHJCVCXFHE-UHFFFAOYSA-N
XLogP2.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-[[methyl-[(4-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine
CID 55093693
2-[2-[methyl-[(3-methylphenyl)methyl]amino]ethyl]-N-propylcyclopentan-1-amine
CID 79577299
2-[[(4-bromophenyl)methyl-methylamino]methyl]-N-methylcyclohexan-1-amine
CID 62614973
N-ethyl-3-[[methyl-[(3-methylphenyl)methyl]amino]methyl]oxan-4-amine
CID 103059842
2-[[(3-bromophenyl)methyl-methylamino]methyl]-N-propylcyclopentan-1-amine
CID 62609650
N-methyl-2-[[methyl(thiophen-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62616177
N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline
CID 62609293
1-N-methyl-2-N-[(3-methylphenyl)methyl]cyclohexane-1,2-diamine
CID 170325151
2-[[benzyl(ethyl)amino]methyl]-N-methylcyclopentan-1-amine
CID 62614486
2-[[benzyl(propan-2-yl)amino]methyl]-N-methylcyclopentan-1-amine
CID 55094082
2-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]cyclopentan-1-amine
CID 61414255
2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]-4-propylcyclohexan-1-ol
CID 63490128

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine?
The IUPAC name of N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine (CID 62610042) is N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine.
What is the SMILES notation for N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine?
The canonical SMILES for N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine is CNC1CCCC1CN(C)Cc1cccc(C)c1.
What is the InChIKey of N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine?
The InChIKey is QXWHOHJCVCXFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-13-6-4-7-14(10-13)11-18(3)12-15-8-5-9-16(15)17-2/h4,6-7,10,15-17H,5,8-9,11-12H2,1-3H3.
What are the key properties of N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine?
N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine has a molecular weight of 246.40 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine is sourced from PubChem (CID 62610042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).