N-(1-pyridin-4-ylethyl)pentanamide

C12H18N2O — CID 17330746

IUPACN-(1-pyridin-4-ylethyl)pentanamide
SMILESCCCCC(=O)NC(C)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-3-4-5-12(15)14-10(2)11-6-8-13-9-7-11/h6-10H,3-5H2,1-2H3,(H,14,15)
InChIKeyMRYWDHPHVUBNNT-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.45
Rot. Bonds5

About N-(1-pyridin-4-ylethyl)pentanamide

N-(1-pyridin-4-ylethyl)pentanamide (PubChem CID 17330746) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-(1-pyridin-4-ylethyl)pentanamide.

Molecular Properties

Compound NameN-(1-pyridin-4-ylethyl)pentanamide
PubChem CID17330746
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-(1-pyridin-4-ylethyl)pentanamide
SMILESCCCCC(=O)NC(C)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-3-4-5-12(15)14-10(2)11-6-8-13-9-7-11/h6-10H,3-5H2,1-2H3,(H,14,15)
InChIKeyMRYWDHPHVUBNNT-UHFFFAOYSA-N
XLogP2.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[(1R)-1-pyridin-4-ylethyl]pentanamide
CID 81405502
3-(ethylamino)-N-[(1R)-1-pyridin-4-ylethyl]propanamide
CID 81410608
4-phenyl-N-[(1R)-1-pyridin-4-ylethyl]butanamide
CID 7346867
2-amino-N-[(1S)-1-pyridin-4-ylethyl]hexanamide
CID 81409725
5-amino-4-methyl-N-(1-pyridin-4-ylethyl)pentanamide
CID 82016946
2-(methylamino)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 81409723
N-[(1S)-1-phenylethyl]decanamide
CID 98131360
2-(butan-2-ylamino)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 81409809
3-(methanesulfonamido)-N-[(1S)-1-pyridin-4-ylethyl]propanamide
CID 94149516
N-[(1R)-1-[4-(carbamoylamino)phenyl]ethyl]pentanamide
CID 94066123
4-(4-acetylphenoxy)-N-[(1R)-1-pyridin-4-ylethyl]butanamide
CID 34762946
N-pentan-2-yl-2-(1-pyridin-4-ylethylamino)acetamide
CID 60693847

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-4-ylethyl)pentanamide?
The IUPAC name of N-(1-pyridin-4-ylethyl)pentanamide (CID 17330746) is N-(1-pyridin-4-ylethyl)pentanamide.
What is the SMILES notation for N-(1-pyridin-4-ylethyl)pentanamide?
The canonical SMILES for N-(1-pyridin-4-ylethyl)pentanamide is CCCCC(=O)NC(C)c1ccncc1.
What is the InChIKey of N-(1-pyridin-4-ylethyl)pentanamide?
The InChIKey is MRYWDHPHVUBNNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-3-4-5-12(15)14-10(2)11-6-8-13-9-7-11/h6-10H,3-5H2,1-2H3,(H,14,15).
What are the key properties of N-(1-pyridin-4-ylethyl)pentanamide?
N-(1-pyridin-4-ylethyl)pentanamide has a molecular weight of 206.29 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-4-ylethyl)pentanamide is sourced from PubChem (CID 17330746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).