5-amino-N-ethyl-N-pyridin-4-ylhexanamide

C13H21N3O — CID 106935326

IUPAC5-amino-N-ethyl-N-pyridin-4-ylhexanamide
SMILESCCN(C(=O)CCCC(C)N)c1ccncc1
InChIInChI=1S/C13H21N3O/c1-3-16(12-7-9-15-10-8-12)13(17)6-4-5-11(2)14/h7-11H,3-6,14H2,1-2H3
InChIKeyLHBVEXLQKQSPCS-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.95
Rot. Bonds6

About 5-amino-N-ethyl-N-pyridin-4-ylhexanamide

5-amino-N-ethyl-N-pyridin-4-ylhexanamide (PubChem CID 106935326) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-amino-N-ethyl-N-pyridin-4-ylhexanamide.

Molecular Properties

Compound Name5-amino-N-ethyl-N-pyridin-4-ylhexanamide
PubChem CID106935326
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-amino-N-ethyl-N-pyridin-4-ylhexanamide
SMILESCCN(C(=O)CCCC(C)N)c1ccncc1
InChIInChI=1S/C13H21N3O/c1-3-16(12-7-9-15-10-8-12)13(17)6-4-5-11(2)14/h7-11H,3-6,14H2,1-2H3
InChIKeyLHBVEXLQKQSPCS-UHFFFAOYSA-N
XLogP1.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-ethyl-4-methyl-N-pyridin-4-ylpentanamide
CID 106935520
(2R)-2-amino-N-ethyl-N-pyridin-4-ylpropanamide
CID 106935605
3-bromo-N-ethyl-N-pyridin-4-ylpropanamide
CID 106934758
(3S)-3-(aminomethyl)-N-ethyl-5-methyl-N-pyridin-4-ylhexanamide
CID 106935311
N-hexyl-N-pyridin-4-yloctanamide
CID 102480897
5-amino-N-methyl-N-pyridin-3-ylhexanamide
CID 82852147
2-[N-(5-aminohexanoyl)-4-methylanilino]acetic acid
CID 82852404
propan-2-yl N-ethyl-N-pyridin-4-ylcarbamate
CID 106934812
hexan-2-amine;pyridine-4-carboxylic acid
CID 159105721
5-amino-N-ethyl-N-methylhexanamide
CID 82848384
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
2-amino-N-ethyl-2-methyl-N-pyridin-4-ylbutanamide
CID 106935267

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-ethyl-N-pyridin-4-ylhexanamide?
The IUPAC name of 5-amino-N-ethyl-N-pyridin-4-ylhexanamide (CID 106935326) is 5-amino-N-ethyl-N-pyridin-4-ylhexanamide.
What is the SMILES notation for 5-amino-N-ethyl-N-pyridin-4-ylhexanamide?
The canonical SMILES for 5-amino-N-ethyl-N-pyridin-4-ylhexanamide is CCN(C(=O)CCCC(C)N)c1ccncc1.
What is the InChIKey of 5-amino-N-ethyl-N-pyridin-4-ylhexanamide?
The InChIKey is LHBVEXLQKQSPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-16(12-7-9-15-10-8-12)13(17)6-4-5-11(2)14/h7-11H,3-6,14H2,1-2H3.
What are the key properties of 5-amino-N-ethyl-N-pyridin-4-ylhexanamide?
5-amino-N-ethyl-N-pyridin-4-ylhexanamide has a molecular weight of 235.33 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-ethyl-N-pyridin-4-ylhexanamide is sourced from PubChem (CID 106935326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).