N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide

C14H27N3O2 — CID 43398679

IUPACN-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
SMILESCCCNC(=O)CNC(C)C(=O)NC1CCCCC1
InChIInChI=1S/C14H27N3O2/c1-3-9-15-13(18)10-16-11(2)14(19)17-12-7-5-4-6-8-12/h11-12,16H,3-10H2,1-2H3,(H,15,18)(H,17,19)
InChIKeyKZQMEGFMTGAMKK-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.94
Rot. Bonds7

About N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide

N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide (PubChem CID 43398679) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
PubChem CID43398679
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
SMILESCCCNC(=O)CNC(C)C(=O)NC1CCCCC1
InChIInChI=1S/C14H27N3O2/c1-3-9-15-13(18)10-16-11(2)14(19)17-12-7-5-4-6-8-12/h11-12,16H,3-10H2,1-2H3,(H,15,18)(H,17,19)
InChIKeyKZQMEGFMTGAMKK-UHFFFAOYSA-N
XLogP0.94
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R)-1-cycloheptylethyl]amino]-N-propylacetamide
CID 81393570
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
2-(butylamino)-N-cyclopentylpropanamide
CID 43083458
2-(cyclohexylcarbamoylamino)-N-propylpropanamide
CID 47112302
(2R)-N-cyclohexyl-2-(hexylamino)propanamide
CID 95357979
N-butyl-2-[[(1R)-1-cyclohexylethyl]amino]acetamide
CID 81384625
N-cyclopropyl-2-[[2-(cyclopropylmethylamino)-2-oxoethyl]amino]propanamide
CID 112623674
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-pentylpropanamide
CID 43420338
(2R)-2-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanoic acid
CID 83194051
2-(3-butoxypropylamino)-N-cyclohexylpropanamide
CID 115569811
N-cyclohexyl-2-(2-ethoxyethylamino)propanamide
CID 43591067
methyl 2-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanoate
CID 60691118

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide?
The IUPAC name of N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide (CID 43398679) is N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide.
What is the SMILES notation for N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide?
The canonical SMILES for N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide is CCCNC(=O)CNC(C)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide?
The InChIKey is KZQMEGFMTGAMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-9-15-13(18)10-16-11(2)14(19)17-12-7-5-4-6-8-12/h11-12,16H,3-10H2,1-2H3,(H,15,18)(H,17,19).
What are the key properties of N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide?
N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide has a molecular weight of 269.39 g/mol, XLogP of 0.94, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide is sourced from PubChem (CID 43398679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).