N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide

C14H21N5O — CID 70719534

IUPACN,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)N(C)CCc2cn[nH]c2)n(C)n1
InChIInChI=1S/C14H21N5O/c1-10(2)12-7-13(19(4)17-12)14(20)18(3)6-5-11-8-15-16-9-11/h7-10H,5-6H2,1-4H3,(H,15,16)
InChIKeyLXLFYBODGRVXAW-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.58
Rot. Bonds5

About N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide

N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide (PubChem CID 70719534) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide
PubChem CID70719534
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)N(C)CCc2cn[nH]c2)n(C)n1
InChIInChI=1S/C14H21N5O/c1-10(2)12-7-13(19(4)17-12)14(20)18(3)6-5-11-8-15-16-9-11/h7-10H,5-6H2,1-4H3,(H,15,16)
InChIKeyLXLFYBODGRVXAW-UHFFFAOYSA-N
XLogP1.58
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]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

US10022354, Example 123
CID 121279532
US10022354, Example 59
CID 121279710
US10022354, Example 27
CID 121279544
US10022354, Example 58
CID 132070185
US10022354, Example 239
CID 121279651
2-methyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide
CID 137634783
N-[(5-tert-butyl-1H-pyrazol-3-yl)methyl]-4-chloro-1-methyl-1H-pyrazole-5-carboxamide
CID 843652
US10022354, Example 165
CID 121279436
US10022354, Example 124
CID 121279533
US10022354, Example 113
CID 121279595
US10022354, Example 238
CID 121279601
US10022354, Example 234
CID 121279612

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide?
The IUPAC name of N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide (CID 70719534) is N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide.
What is the SMILES notation for N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide?
The canonical SMILES for N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide is CC(C)c1cc(C(=O)N(C)CCc2cn[nH]c2)n(C)n1.
What is the InChIKey of N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide?
The InChIKey is LXLFYBODGRVXAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10(2)12-7-13(19(4)17-12)14(20)18(3)6-5-11-8-15-16-9-11/h7-10H,5-6H2,1-4H3,(H,15,16).
What are the key properties of N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide?
N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide has a molecular weight of 275.36 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-3-propan-2-yl-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazole-5-carboxamide is sourced from PubChem (CID 70719534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).