N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride

C18H23ClN4O — CID 119297684

IUPACN-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCc1nn(-c2ccccc2)c2c1CCC2)C1CCCN1
InChIInChI=1S/C18H22N4O.ClH/c23-18(15-9-5-11-19-15)20-12-16-14-8-4-10-17(14)22(21-16)13-6-2-1-3-7-13;/h1-3,6-7,15,19H,4-5,8-12H2,(H,20,23);1H
InChIKeyUVRNPNFGCGHUIG-UHFFFAOYSA-N
MW346.86 g/mol
LogP2.15
Rot. Bonds4

About N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride

N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119297684) has the molecular formula C18H23ClN4O and a molecular weight of 346.86 g/mol. Its IUPAC name is N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119297684
Molecular FormulaC18H23ClN4O
Molecular Weight346.86 g/mol
Exact Mass346.16
IUPAC NameN-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCc1nn(-c2ccccc2)c2c1CCC2)C1CCCN1
InChIInChI=1S/C18H22N4O.ClH/c23-18(15-9-5-11-19-15)20-12-16-14-8-4-10-17(14)22(21-16)13-6-2-1-3-7-13;/h1-3,6-7,15,19H,4-5,8-12H2,(H,20,23);1H
InChIKeyUVRNPNFGCGHUIG-UHFFFAOYSA-N
XLogP2.15
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride with MolForge

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Related Compounds

2-amino-3-methoxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]propanamide;hydrochloride
CID 120986692
3-benzamido-4-methyl-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]benzamide
CID 55862192
N-benzyl-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 17492126
3-(chloromethyl)-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
CID 14576151
1-phenyl-N-pyrrolidin-3-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide;hydrochloride
CID 119450844
(2S)-N-[(2-bromophenyl)methyl]pyrrolidine-2-carboxamide
CID 61402429
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanone
CID 120657503
3-(3-but-3-ynyldiazirin-3-yl)-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]propanamide
CID 166409248
2-(2,5-dichlorophenoxy)-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]acetamide
CID 55861932
1-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-3-carboxylic acid
CID 119904476
(2S)-N-[(2-methylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119688344
N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 119836618

Frequently Asked Questions

What is the IUPAC name of N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride (CID 119297684) is N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride is Cl.O=C(NCc1nn(-c2ccccc2)c2c1CCC2)C1CCCN1.
What is the InChIKey of N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is UVRNPNFGCGHUIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O.ClH/c23-18(15-9-5-11-19-15)20-12-16-14-8-4-10-17(14)22(21-16)13-6-2-1-3-7-13;/h1-3,6-7,15,19H,4-5,8-12H2,(H,20,23);1H.
What are the key properties of N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride?
N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 346.86 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119297684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).