N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine

C19H32N2 — CID 62262841

IUPACN-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCN(Cc1ccccc1)CC1(CNC(C)(C)C)CCCC1
InChIInChI=1S/C19H32N2/c1-18(2,3)20-15-19(12-8-9-13-19)16-21(4)14-17-10-6-5-7-11-17/h5-7,10-11,20H,8-9,12-16H2,1-4H3
InChIKeyBRRMKHLKVCMNBI-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.07
Rot. Bonds6

About N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine

N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine (PubChem CID 62262841) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
PubChem CID62262841
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCN(Cc1ccccc1)CC1(CNC(C)(C)C)CCCC1
InChIInChI=1S/C19H32N2/c1-18(2,3)20-15-19(12-8-9-13-19)16-21(4)14-17-10-6-5-7-11-17/h5-7,10-11,20H,8-9,12-16H2,1-4H3
InChIKeyBRRMKHLKVCMNBI-UHFFFAOYSA-N
XLogP4.07
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine (CID 62262841) is N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine is CN(Cc1ccccc1)CC1(CNC(C)(C)C)CCCC1.
What is the InChIKey of N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine?
The InChIKey is BRRMKHLKVCMNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-18(2,3)20-15-19(12-8-9-13-19)16-21(4)14-17-10-6-5-7-11-17/h5-7,10-11,20H,8-9,12-16H2,1-4H3.
What are the key properties of N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine?
N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine has a molecular weight of 288.48 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62262841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).