N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide

C17H24N6O — CID 167754818

IUPACN-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide
SMILESCCC(NC(=O)C(Cc1nn[nH]n1)c1ccccn1)C1CCCC1
InChIInChI=1S/C17H24N6O/c1-2-14(12-7-3-4-8-12)19-17(24)13(11-16-20-22-23-21-16)15-9-5-6-10-18-15/h5-6,9-10,12-14H,2-4,7-8,11H2,1H3,(H,19,24)(H,20,21,22,23)
InChIKeyBEEYNNFZXGIQIM-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.01
Rot. Bonds7

About N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide

N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide (PubChem CID 167754818) has the molecular formula C17H24N6O and a molecular weight of 328.42 g/mol. Its IUPAC name is N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide.

Molecular Properties

Compound NameN-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide
PubChem CID167754818
Molecular FormulaC17H24N6O
Molecular Weight328.42 g/mol
Exact Mass328.20
IUPAC NameN-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide
SMILESCCC(NC(=O)C(Cc1nn[nH]n1)c1ccccn1)C1CCCC1
InChIInChI=1S/C17H24N6O/c1-2-14(12-7-3-4-8-12)19-17(24)13(11-16-20-22-23-21-16)15-9-5-6-10-18-15/h5-6,9-10,12-14H,2-4,7-8,11H2,1H3,(H,19,24)(H,20,21,22,23)
InChIKeyBEEYNNFZXGIQIM-UHFFFAOYSA-N
XLogP2.01
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 21278990
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CID 60819908
tert-butyl N-(1-cyclohexyl-3-hydroxy-3-pyridin-2-ylpropyl)carbamate
CID 70041530
N-cyclopentyl-2-(4-fluorophenyl)-2-pyridin-2-ylacetamide
CID 110373528
N-(1-cyclohexylpropyl)-2-sulfanylbenzamide
CID 107028366
3-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanoic acid
CID 82127415
1-cyclohexyl-3-(dipyridin-2-ylmethyl)urea
CID 11225540
(2S)-2-amino-N-(1-pyridin-2-ylethyl)butanamide
CID 79024975
4-carbamothioyl-N-(1-cyclohexylpropyl)benzamide
CID 62405626
N-cyclopentyl-2-phenyl-3-pyridin-2-ylpropanamide
CID 110407019
2-amino-N-(1-cyclohexylpropyl)-2-thiophen-2-ylacetamide
CID 115287171

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide?
The IUPAC name of N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide (CID 167754818) is N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide.
What is the SMILES notation for N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide?
The canonical SMILES for N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide is CCC(NC(=O)C(Cc1nn[nH]n1)c1ccccn1)C1CCCC1.
What is the InChIKey of N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide?
The InChIKey is BEEYNNFZXGIQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O/c1-2-14(12-7-3-4-8-12)19-17(24)13(11-16-20-22-23-21-16)15-9-5-6-10-18-15/h5-6,9-10,12-14H,2-4,7-8,11H2,1H3,(H,19,24)(H,20,21,22,23).
What are the key properties of N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide?
N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide has a molecular weight of 328.42 g/mol, XLogP of 2.01, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylpropyl)-2-pyridin-2-yl-3-(2H-tetrazol-5-yl)propanamide is sourced from PubChem (CID 167754818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).