N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide

C19H30N2O — CID 56570177

IUPACN-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)CN(C(C)C)C1CCCC1
InChIInChI=1S/C19H30N2O/c1-4-20(14-17-10-6-5-7-11-17)19(22)15-21(16(2)3)18-12-8-9-13-18/h5-7,10-11,16,18H,4,8-9,12-15H2,1-3H3
InChIKeyWEVDIPPXCOCQPI-UHFFFAOYSA-N
MW302.46 g/mol
LogP3.69
Rot. Bonds7

About N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide

N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide (PubChem CID 56570177) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide.

Molecular Properties

Compound NameN-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide
PubChem CID56570177
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC NameN-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)CN(C(C)C)C1CCCC1
InChIInChI=1S/C19H30N2O/c1-4-20(14-17-10-6-5-7-11-17)19(22)15-21(16(2)3)18-12-8-9-13-18/h5-7,10-11,16,18H,4,8-9,12-15H2,1-3H3
InChIKeyWEVDIPPXCOCQPI-UHFFFAOYSA-N
XLogP3.69
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-[benzyl(ethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 60839143
N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
CID 95322825
N-benzyl-N-ethyl-2-[(2-hydroxycyclopentyl)methyl-methylamino]acetamide
CID 109398007
N-benzyl-N-ethylcyclobutanecarboxamide
CID 110755489
2-[[benzyl(ethyl)carbamoyl]-cyclopropylamino]acetic acid
CID 61186434
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
N'-benzyl-N'-ethyl-N-propan-2-ylpropanediamide
CID 108940808
N-benzyl-2-(4-benzylpiperidin-1-yl)-N-ethylacetamide
CID 108998987
1-(4-benzylpiperazin-1-yl)-2-[cyclopentyl(propan-2-yl)amino]ethanone
CID 56570110
N-benzyl-2-[cyclopropyl-[(3-methylphenyl)methyl]amino]-N-ethylacetamide
CID 52676957
N-benzyl-2-(dipropylamino)-N-ethylacetamide
CID 108998990
N-benzyl-N-ethyl-3-(propan-2-ylamino)propanamide
CID 60854868

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide?
The IUPAC name of N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide (CID 56570177) is N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide.
What is the SMILES notation for N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide?
The canonical SMILES for N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide is CCN(Cc1ccccc1)C(=O)CN(C(C)C)C1CCCC1.
What is the InChIKey of N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide?
The InChIKey is WEVDIPPXCOCQPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c1-4-20(14-17-10-6-5-7-11-17)19(22)15-21(16(2)3)18-12-8-9-13-18/h5-7,10-11,16,18H,4,8-9,12-15H2,1-3H3.
What are the key properties of N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide?
N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide has a molecular weight of 302.46 g/mol, XLogP of 3.69, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide is sourced from PubChem (CID 56570177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).