N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

C19H26N4O3 — CID 52518675

IUPACN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCN(C)CCn1cc(NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cn1
InChIInChI=1S/C19H26N4O3/c1-22(2)9-10-23-13-16(12-20-23)21-19(24)15-5-7-17(8-6-15)26-14-18-4-3-11-25-18/h5-8,12-13,18H,3-4,9-11,14H2,1-2H3,(H,21,24)/t18-/m1/s1
InChIKeyIQYPBTGKHHQSGV-GOSISDBHSA-N
MW358.44 g/mol
LogP2.25
Rot. Bonds8

About N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (PubChem CID 52518675) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
PubChem CID52518675
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCN(C)CCn1cc(NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cn1
InChIInChI=1S/C19H26N4O3/c1-22(2)9-10-23-13-16(12-20-23)21-19(24)15-5-7-17(8-6-15)26-14-18-4-3-11-25-18/h5-8,12-13,18H,3-4,9-11,14H2,1-2H3,(H,21,24)/t18-/m1/s1
InChIKeyIQYPBTGKHHQSGV-GOSISDBHSA-N
XLogP2.25
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide 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

N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 42932973
3-(4-methylpyrazol-1-yl)-N-[4-[[(2R)-oxan-2-yl]methoxy]phenyl]propanamide
CID 164641994
N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909
methyl 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzoate
CID 17222269
4-(2-methoxyethoxy)-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 40796712
N-(3-methoxypropyl)-4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
CID 17222449
N-(3,4-dimethylphenyl)-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580258
N-[1-[[(2R)-oxan-2-yl]methyl]pyrazol-4-yl]-4-(trifluoromethoxy)benzamide
CID 129356006
4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
CID 4786441
N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]pyridine-4-carboxamide
CID 7447165
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 55587996

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (CID 52518675) is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.
What is the SMILES notation for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The canonical SMILES for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is CN(C)CCn1cc(NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cn1.
What is the InChIKey of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The InChIKey is IQYPBTGKHHQSGV-GOSISDBHSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-22(2)9-10-23-13-16(12-20-23)21-19(24)15-5-7-17(8-6-15)26-14-18-4-3-11-25-18/h5-8,12-13,18H,3-4,9-11,14H2,1-2H3,(H,21,24)/t18-/m1/s1.
What are the key properties of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide has a molecular weight of 358.44 g/mol, XLogP of 2.25, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is sourced from PubChem (CID 52518675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).