N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide

C19H28N4O2 — CID 42346225

IUPACN-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccnn1C1CCN(C(=O)C2=CCCC2)CC1
InChIInChI=1S/C19H28N4O2/c1-19(2,3)18(25)21-16-8-11-20-23(16)15-9-12-22(13-10-15)17(24)14-6-4-5-7-14/h6,8,11,15H,4-5,7,9-10,12-13H2,1-3H3,(H,21,25)
InChIKeyKAMBTCPNILQOMW-UHFFFAOYSA-N
MW344.46 g/mol
LogP3.14
Rot. Bonds3

About N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide

N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide (PubChem CID 42346225) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
PubChem CID42346225
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccnn1C1CCN(C(=O)C2=CCCC2)CC1
InChIInChI=1S/C19H28N4O2/c1-19(2,3)18(25)21-16-8-11-20-23(16)15-9-12-22(13-10-15)17(24)14-6-4-5-7-14/h6,8,11,15H,4-5,7,9-10,12-13H2,1-3H3,(H,21,25)
InChIKeyKAMBTCPNILQOMW-UHFFFAOYSA-N
XLogP3.14
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-{1-[1-(2,6-dimethyl-5-hepten-1-yl)-4-piperidinyl]-1H-pyrazol-5-yl}cyclopentanecarboxamide
CID 24818932
(6R)-9-fluoro-13,13-dimethyl-2,11,15,19,20,23-hexazapentacyclo[15.5.2.17,11.02,6.020,24]pentacosa-1(23),7,9,17(24),18,21-hexaene-16,25-dione
CID 54670354
2-(2-methyl-3-oxo-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 72119584
1,8,12-Triazatricyclo[7.3.0.0,2,6]dodeca-2(6),9,11-trien-7-one
CID 136773914
N-(3-methylbutyl)-4-(4-methyl-7-oxopyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxamide
CID 53146890
3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-(1-methylpyrazol-3-yl)propanamide
CID 31851906
2-methyl-N-[2-[(2S)-3-methylbutan-2-yl]pyrazol-3-yl]-6-oxo-1H-pyridine-4-carboxamide
CID 52381063
N-(2-cyclopentylpyrazol-3-yl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 71973413
N-[1-(3-amino-3-oxopropyl)pyrazol-3-yl]cycloheptene-1-carboxamide
CID 91648963
N-[2-[[1-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-3,6-dihydro-2H-pyridin-5-yl]methyl]pyrazol-3-yl]acetamide
CID 95120661
3-[(2R)-1-[2-(3-bromo-2,2-dimethylpropyl)pyrazol-3-yl]pyrrolidin-2-yl]-5-fluoro-1H-pyridin-2-one
CID 177733542
2,2-dimethyl-N-{1-[1-(4,4,4-trifluorobutanoyl)-4-piperidinyl]-1H-pyrazol-5-yl}propanamide
CID 26395668

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide (CID 42346225) is N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1ccnn1C1CCN(C(=O)C2=CCCC2)CC1.
What is the InChIKey of N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The InChIKey is KAMBTCPNILQOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-19(2,3)18(25)21-16-8-11-20-23(16)15-9-12-22(13-10-15)17(24)14-6-4-5-7-14/h6,8,11,15H,4-5,7,9-10,12-13H2,1-3H3,(H,21,25).
What are the key properties of N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide has a molecular weight of 344.46 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 42346225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).