N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide

C19H24N4O2 — CID 166297085

IUPACN-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
SMILESO=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C19H24N4O2/c24-18-10-13(12-23-8-2-7-21-23)9-17(18)22-19(25)15-4-5-16-14(11-15)3-1-6-20-16/h2,4-5,7-8,11,13,17-18,20,24H,1,3,6,9-10,12H2,(H,22,25)/t13?,17-,18-/m1/s1
InChIKeyMZVXZMYWIXDDKK-NGKGQXKNSA-N
MW340.43 g/mol
LogP1.81
Rot. Bonds4

About N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide

N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide (PubChem CID 166297085) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
PubChem CID166297085
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
SMILESO=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C19H24N4O2/c24-18-10-13(12-23-8-2-7-21-23)9-17(18)22-19(25)15-4-5-16-14(11-15)3-1-6-20-16/h2,4-5,7-8,11,13,17-18,20,24H,1,3,6,9-10,12H2,(H,22,25)/t13?,17-,18-/m1/s1
InChIKeyMZVXZMYWIXDDKK-NGKGQXKNSA-N
XLogP1.81
TPSA79.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide with MolForge

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Related Compounds

N-(2-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 62360933
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-4-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 146113906
N-(3-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 43696101
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]isoquinoline-3-carboxamide
CID 166286067
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 146110037
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]isoquinoline-1-carboxamide
CID 166286123
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1H-indole-7-carboxamide
CID 146110002
1-cyano-N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-5,6,7,8-tetrahydroindolizine-3-carboxamide
CID 146113832
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]quinoxaline-5-carboxamide
CID 146113903
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 146113881
2-pyrazol-1-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
CID 63282524
N-[(1R,2R)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 107221941

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide?
The IUPAC name of N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide (CID 166297085) is N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide.
What is the SMILES notation for N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide?
The canonical SMILES for N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide is O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1ccc2c(c1)CCCN2.
What is the InChIKey of N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide?
The InChIKey is MZVXZMYWIXDDKK-NGKGQXKNSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-18-10-13(12-23-8-2-7-21-23)9-17(18)22-19(25)15-4-5-16-14(11-15)3-1-6-20-16/h2,4-5,7-8,11,13,17-18,20,24H,1,3,6,9-10,12H2,(H,22,25)/t13?,17-,18-/m1/s1.
What are the key properties of N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide?
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 1.81, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide is sourced from PubChem (CID 166297085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).