N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide

C17H27N3O — CID 114290026

IUPACN-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide
SMILESCCCN(CC1CCNCC1)C(=O)CCc1ccccn1
InChIInChI=1S/C17H27N3O/c1-2-13-20(14-15-8-11-18-12-9-15)17(21)7-6-16-5-3-4-10-19-16/h3-5,10,15,18H,2,6-9,11-14H2,1H3
InChIKeyFAKCIJUHUCHASN-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.25
Rot. Bonds7

About N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide

N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide (PubChem CID 114290026) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide
PubChem CID114290026
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide
SMILESCCCN(CC1CCNCC1)C(=O)CCc1ccccn1
InChIInChI=1S/C17H27N3O/c1-2-13-20(14-15-8-11-18-12-9-15)17(21)7-6-16-5-3-4-10-19-16/h3-5,10,15,18H,2,6-9,11-14H2,1H3
InChIKeyFAKCIJUHUCHASN-UHFFFAOYSA-N
XLogP2.25
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide
CID 106628102
3-phenyl-N-(piperidin-4-ylmethyl)-N-propylpropanamide
CID 79701291
2-[propyl(3-pyridin-2-ylpropanoyl)amino]acetic acid
CID 114289646
2-phenyl-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79720329
N-ethyl-3-pyridin-2-yl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106608852
2-(2-methylphenyl)-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79702981
N-(cyclopropylmethyl)-3-piperidin-4-yl-N-propylpropanamide
CID 62211914
N-(cyclopropylmethyl)-2-[(2R)-3-oxo-1-(pyridin-2-ylmethyl)piperazin-2-yl]-N-propylacetamide
CID 95714500
N-[(4S)-azepan-4-yl]-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 129398997
N-(piperidin-4-ylmethyl)-N-propylpent-4-enamide
CID 79721360
N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide
CID 106628128
4-oxo-4-phenyl-N-propyl-N-(2-pyridin-2-ylethyl)butanamide
CID 49031326

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide?
The IUPAC name of N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide (CID 114290026) is N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide.
What is the SMILES notation for N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide?
The canonical SMILES for N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide is CCCN(CC1CCNCC1)C(=O)CCc1ccccn1.
What is the InChIKey of N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide?
The InChIKey is FAKCIJUHUCHASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-13-20(14-15-8-11-18-12-9-15)17(21)7-6-16-5-3-4-10-19-16/h3-5,10,15,18H,2,6-9,11-14H2,1H3.
What are the key properties of N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide?
N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide has a molecular weight of 289.42 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 114290026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).