N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide

C15H26N2O2 — CID 154779010

IUPACN-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide
SMILESC=CC(=O)NC(CCC)C(=O)N(CC)C1CCCC1
InChIInChI=1S/C15H26N2O2/c1-4-9-13(16-14(18)5-2)15(19)17(6-3)12-10-7-8-11-12/h5,12-13H,2,4,6-11H2,1,3H3,(H,16,18)
InChIKeyUYENCOQGILOTNJ-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.25
Rot. Bonds7

About N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide

N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide (PubChem CID 154779010) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide
PubChem CID154779010
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide
SMILESC=CC(=O)NC(CCC)C(=O)N(CC)C1CCCC1
InChIInChI=1S/C15H26N2O2/c1-4-9-13(16-14(18)5-2)15(19)17(6-3)12-10-7-8-11-12/h5,12-13H,2,4,6-11H2,1,3H3,(H,16,18)
InChIKeyUYENCOQGILOTNJ-UHFFFAOYSA-N
XLogP2.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-(prop-2-enoylamino)pentanoic acid
CID 18798141
2-[[cyclopropyl(ethyl)carbamoyl]amino]pentanoic acid
CID 61196558
N-cyclopentyl-N-ethyl-2-methylpropanamide
CID 60738891
(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid
CID 107566149
N-[1-(diethylamino)butyl]prop-2-enamide
CID 139534809
N-(4-aminocyclohexyl)-N-ethyl-2-methylpentanamide
CID 79115926
2-[[cyclopentyl(ethyl)carbamoyl]amino]-4-hydroxybutanoic acid
CID 61227565
2-[[cycloheptyl(methyl)carbamoyl]amino]pentanoic acid
CID 61201099
N-cyclohexyl-N-ethyl-2,2-difluoroacetamide
CID 103515263
2-bromo-N-cyclohexyl-N-ethylpropanamide
CID 82110731
1-cyclohexyl-1-ethyl-3-(1-phenylbutyl)urea
CID 112806156
N-(azetidin-3-yl)-N-ethyl-2-methylpentanamide
CID 66183175

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide?
The IUPAC name of N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide (CID 154779010) is N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide is C=CC(=O)NC(CCC)C(=O)N(CC)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide?
The InChIKey is UYENCOQGILOTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-9-13(16-14(18)5-2)15(19)17(6-3)12-10-7-8-11-12/h5,12-13H,2,4,6-11H2,1,3H3,(H,16,18).
What are the key properties of N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide?
N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide has a molecular weight of 266.38 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-2-(prop-2-enoylamino)pentanamide is sourced from PubChem (CID 154779010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).