N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide

C16H27N3O — CID 79099453

IUPACN-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
SMILESCCCNC(C)c1ccn(CC(=O)NC2CCCC2)c1
InChIInChI=1S/C16H27N3O/c1-3-9-17-13(2)14-8-10-19(11-14)12-16(20)18-15-6-4-5-7-15/h8,10-11,13,15,17H,3-7,9,12H2,1-2H3,(H,18,20)
InChIKeyZRWNZTFGSIXLHO-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.61
Rot. Bonds7

About N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide

N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide (PubChem CID 79099453) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
PubChem CID79099453
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
SMILESCCCNC(C)c1ccn(CC(=O)NC2CCCC2)c1
InChIInChI=1S/C16H27N3O/c1-3-9-17-13(2)14-8-10-19(11-14)12-16(20)18-15-6-4-5-7-15/h8,10-11,13,15,17H,3-7,9,12H2,1-2H3,(H,18,20)
InChIKeyZRWNZTFGSIXLHO-UHFFFAOYSA-N
XLogP2.61
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxan-4-yl)-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
CID 79109161
N-(2-methylbutan-2-yl)-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
CID 79098481
N-(3-methoxypropyl)-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide
CID 79098591
2-[3-[1-(methylamino)butyl]pyrrol-1-yl]-N-(oxan-4-yl)acetamide
CID 79108233
N-[1-[1-(2,2,2-trifluoroethyl)pyrrol-3-yl]ethyl]propan-1-amine
CID 79099254
N-cyclopropyl-2-[3-[1-(propylamino)ethyl]phenyl]sulfanylacetamide
CID 64664243
N-cyclohexyl-2-[3-[(cyclopropylamino)methyl]pyrrol-1-yl]acetamide
CID 66404977
N-cyclopropyl-3-[3-[1-(methylamino)ethyl]pyrrol-1-yl]propanamide
CID 79098648
N-cyclopropyl-2-[3-(ethylaminomethyl)pyrrol-1-yl]acetamide
CID 66406741
N-cyclopentyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409773
N-(cyclopropylmethyl)-2-[3-(1-hydroxyethyl)pyrrol-1-yl]acetamide
CID 79107389
N-butyl-2-[3-[1-(propylamino)propyl]pyrrol-1-yl]acetamide
CID 79105170

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide (CID 79099453) is N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide is CCCNC(C)c1ccn(CC(=O)NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide?
The InChIKey is ZRWNZTFGSIXLHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-3-9-17-13(2)14-8-10-19(11-14)12-16(20)18-15-6-4-5-7-15/h8,10-11,13,15,17H,3-7,9,12H2,1-2H3,(H,18,20).
What are the key properties of N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide?
N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide has a molecular weight of 277.41 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[3-[1-(propylamino)ethyl]pyrrol-1-yl]acetamide is sourced from PubChem (CID 79099453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).