4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride

C19H30ClN3O3 — CID 119760392

IUPAC4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)CCNCC1.Cl
InChIInChI=1S/C19H29N3O3.ClH/c1-13(2)12-21-17(23)15-5-6-16(14(3)11-15)22-18(24)19(25-4)7-9-20-10-8-19;/h5-6,11,13,20H,7-10,12H2,1-4H3,(H,21,23)(H,22,24);1H
InChIKeyYOMZTGPNSGZXBT-UHFFFAOYSA-N
MW383.92 g/mol
LogP2.51
Rot. Bonds6

About 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride

4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119760392) has the molecular formula C19H30ClN3O3 and a molecular weight of 383.92 g/mol. Its IUPAC name is 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride
PubChem CID119760392
Molecular FormulaC19H30ClN3O3
Molecular Weight383.92 g/mol
Exact Mass383.20
IUPAC Name4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)CCNCC1.Cl
InChIInChI=1S/C19H29N3O3.ClH/c1-13(2)12-21-17(23)15-5-6-16(14(3)11-15)22-18(24)19(25-4)7-9-20-10-8-19;/h5-6,11,13,20H,7-10,12H2,1-4H3,(H,21,23)(H,22,24);1H
InChIKeyYOMZTGPNSGZXBT-UHFFFAOYSA-N
XLogP2.51
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.92
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride 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-methoxy-N-(4-methoxy-2-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119709494
4-[(1-aminocyclohexanecarbonyl)amino]-3-methyl-N-(2-methylpropyl)benzamide;hydrochloride
CID 119310067
N-[3-chloro-4-(2-methylpropylcarbamoyl)phenyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119740335
4-methoxy-N-(2-methylpropyl)piperidine-4-carboxamide
CID 119673792
N-(4,5-dimethoxy-2-methylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119679109
(2S,4S)-2-methyl-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 120628608
N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119310041
3-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 122159202
4-methoxy-N-[4-(propylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 119739010
N-ethyl-3-methyl-4-(2-methylpropylcarbamoylamino)benzamide
CID 47264617
N-(3,4-dimethylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119670646
ethyl 4-[(4-methoxypiperidine-4-carbonyl)amino]benzoate
CID 119672458

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride (CID 119760392) is 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride is COC1(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)CCNCC1.Cl.
What is the InChIKey of 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is YOMZTGPNSGZXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3.ClH/c1-13(2)12-21-17(23)15-5-6-16(14(3)11-15)22-18(24)19(25-4)7-9-20-10-8-19;/h5-6,11,13,20H,7-10,12H2,1-4H3,(H,21,23)(H,22,24);1H.
What are the key properties of 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride?
4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 383.92 g/mol, XLogP of 2.51, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-methyl-4-(2-methylpropylcarbamoyl)phenyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119760392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).