2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide

C18H24N4O2 — CID 56789307

IUPAC2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
SMILESCCC(OC1CCCC1)C(=O)Nc1ccn(Cc2ccncc2)n1
InChIInChI=1S/C18H24N4O2/c1-2-16(24-15-5-3-4-6-15)18(23)20-17-9-12-22(21-17)13-14-7-10-19-11-8-14/h7-12,15-16H,2-6,13H2,1H3,(H,20,21,23)
InChIKeyQRXSGDYTYCQJOM-UHFFFAOYSA-N
MW328.42 g/mol
LogP3.00
Rot. Bonds7

About 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide

2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide (PubChem CID 56789307) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide.

Molecular Properties

Compound Name2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
PubChem CID56789307
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
SMILESCCC(OC1CCCC1)C(=O)Nc1ccn(Cc2ccncc2)n1
InChIInChI=1S/C18H24N4O2/c1-2-16(24-15-5-3-4-6-15)18(23)20-17-9-12-22(21-17)13-14-7-10-19-11-8-14/h7-12,15-16H,2-6,13H2,1H3,(H,20,21,23)
InChIKeyQRXSGDYTYCQJOM-UHFFFAOYSA-N
XLogP3.00
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-piperidin-4-yl-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
CID 119871275
N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]piperidine-3-carboxamide;dihydrochloride
CID 119871238
4-amino-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
CID 119871291
1-[4-(oxolan-3-yloxy)phenyl]-3-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]urea
CID 126792061
1-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]urea
CID 166209972
N-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]cyclopropanecarboxamide
CID 19284488
N-(1-benzylpyrazol-3-yl)-2-hydroxycyclopentane-1-carboxamide
CID 110014338
(2R,3S)-2-methyl-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]morpholine-3-carboxamide
CID 120940633
1-(3-phenoxybutan-2-yl)-3-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]urea
CID 166231337
1-(4-methylsulfanylphenyl)-3-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]urea
CID 99836283
1-(2,5-dichlorophenyl)-3-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]urea
CID 51130131
1-[[1-(pyridin-4-ylmethyl)pyrazol-3-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 154865268

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide?
The IUPAC name of 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide (CID 56789307) is 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide.
What is the SMILES notation for 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide?
The canonical SMILES for 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide is CCC(OC1CCCC1)C(=O)Nc1ccn(Cc2ccncc2)n1.
What is the InChIKey of 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide?
The InChIKey is QRXSGDYTYCQJOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-2-16(24-15-5-3-4-6-15)18(23)20-17-9-12-22(21-17)13-14-7-10-19-11-8-14/h7-12,15-16H,2-6,13H2,1H3,(H,20,21,23).
What are the key properties of 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide?
2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide has a molecular weight of 328.42 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide is sourced from PubChem (CID 56789307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).