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

C17H27N3O — CID 106628128

IUPACN-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide
SMILESCCCN(CC1CCCNC1)C(=O)CCc1cccnc1
InChIInChI=1S/C17H27N3O/c1-2-11-20(14-16-6-4-10-19-13-16)17(21)8-7-15-5-3-9-18-12-15/h3,5,9,12,16,19H,2,4,6-8,10-11,13-14H2,1H3
InChIKeyRFEVIKBKCCUBAF-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.25
Rot. Bonds7

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

N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide (PubChem CID 106628128) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide
PubChem CID106628128
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide
SMILESCCCN(CC1CCCNC1)C(=O)CCc1cccnc1
InChIInChI=1S/C17H27N3O/c1-2-11-20(14-16-6-4-10-19-13-16)17(21)8-7-15-5-3-9-18-12-15/h3,5,9,12,16,19H,2,4,6-8,10-11,13-14H2,1H3
InChIKeyRFEVIKBKCCUBAF-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
N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide
CID 60682520
N-(piperidin-3-ylmethyl)-N-propyloctanamide
CID 106628397
N-propyl-N-(pyridin-3-ylmethyl)piperidin-3-amine
CID 55244721
6-methyl-N-(piperidin-3-ylmethyl)-N-propylpyridine-2-carboxamide
CID 106628314
N-(piperidin-4-ylmethyl)-N-propyl-3-pyridin-2-ylpropanamide
CID 114290026
ethyl N-(piperidin-3-ylmethyl)-N-propylcarbamate
CID 106630010
2-[(2-methylpropan-2-yl)oxy]-N-(piperidin-3-ylmethyl)-N-propylacetamide
CID 106628164
2-fluoro-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 106628436
2,3-dihydroxy-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 106628169
N-(piperidin-3-ylmethyl)-N-propyl-2-(1,2,4-triazol-1-yl)acetamide
CID 106628190

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide (CID 106628128) is N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide is CCCN(CC1CCCNC1)C(=O)CCc1cccnc1.
What is the InChIKey of N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The InChIKey is RFEVIKBKCCUBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-11-20(14-16-6-4-10-19-13-16)17(21)8-7-15-5-3-9-18-12-15/h3,5,9,12,16,19H,2,4,6-8,10-11,13-14H2,1H3.
What are the key properties of N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide?
N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-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-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 106628128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).