N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide

C11H19N5O2 — CID 143609180

IUPACN-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide
SMILESCNc1cn[nH]c1C(=O)NC1CCC(N)(O)CC1
InChIInChI=1S/C11H19N5O2/c1-13-8-6-14-16-9(8)10(17)15-7-2-4-11(12,18)5-3-7/h6-7,13,18H,2-5,12H2,1H3,(H,14,16)(H,15,17)
InChIKeyGJBPXQLPJNFNIA-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.23
Rot. Bonds3

About N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide

N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide (PubChem CID 143609180) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide
PubChem CID143609180
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC NameN-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide
SMILESCNc1cn[nH]c1C(=O)NC1CCC(N)(O)CC1
InChIInChI=1S/C11H19N5O2/c1-13-8-6-14-16-9(8)10(17)15-7-2-4-11(12,18)5-3-7/h6-7,13,18H,2-5,12H2,1H3,(H,14,16)(H,15,17)
InChIKeyGJBPXQLPJNFNIA-UHFFFAOYSA-N
XLogP-0.23
TPSA116.06 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(methylamino)-N-(4-thiomorpholin-4-ylcyclohexyl)-1H-pyrazole-5-carboxamide
CID 142995121
N-cyclopropyl-4-methyl-1H-pyrazole-5-carboxamide
CID 110847961
N-cyclopropyl-8-(methylamino)-6-[[5-(methylcarbamoyl)-1H-pyrazol-4-yl]amino]imidazo[1,2-b]pyridazine-3-carboxamide
CID 134417211
4-amino-N-(4-carbamoylcyclohexyl)-1H-pyrazole-5-carboxamide
CID 55176870
4-[(2,6-difluorobenzoyl)amino]-N-[4-(dimethylamino)cyclohexyl]-1H-pyrazole-5-carboxamide
CID 58696395
4-(benzylsulfonylamino)-N-cyclopentyl-1H-pyrazole-5-carboxamide
CID 69379072
N-(4-methoxycyclohexyl)-4-(oxane-4-carbonylamino)-1H-pyrazole-5-carboxamide
CID 118714251
4-benzamido-N-(4-tert-butylcyclohexyl)-1H-pyrazole-5-carboxamide;molecular hydrogen
CID 158915340
4-amino-N-(2,2-dimethyloxan-4-yl)-1H-pyrazole-5-carboxamide
CID 83027249
3-chloro-5-methyl-N-[5-(piperidin-4-ylcarbamoyl)-1H-pyrazol-4-yl]pyridine-4-carboxamide
CID 143263434
N-cyclohexyl-4-[(4-methoxythiophene-3-carbonyl)amino]-1H-pyrazole-5-carboxamide
CID 66978495
4-[(2,6-dichlorobenzoyl)amino]-N-[1-(2-methylpropanoyl)piperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 166167676

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide (CID 143609180) is N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide is CNc1cn[nH]c1C(=O)NC1CCC(N)(O)CC1.
What is the InChIKey of N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide?
The InChIKey is GJBPXQLPJNFNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-13-8-6-14-16-9(8)10(17)15-7-2-4-11(12,18)5-3-7/h6-7,13,18H,2-5,12H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide?
N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide has a molecular weight of 253.31 g/mol, XLogP of -0.23, 3 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-4-hydroxycyclohexyl)-4-(methylamino)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 143609180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).