1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea

C14H22N4O — CID 43744340

IUPAC1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea
SMILESCNC(=O)Nc1ccc(NC2CCN(C)CC2)cc1
InChIInChI=1S/C14H22N4O/c1-15-14(19)17-12-5-3-11(4-6-12)16-13-7-9-18(2)10-8-13/h3-6,13,16H,7-10H2,1-2H3,(H2,15,17,19)
InChIKeyFUFGPZUFQGZGMB-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.94
Rot. Bonds3

About 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea

1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea (PubChem CID 43744340) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea.

Molecular Properties

Compound Name1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea
PubChem CID43744340
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea
SMILESCNC(=O)Nc1ccc(NC2CCN(C)CC2)cc1
InChIInChI=1S/C14H22N4O/c1-15-14(19)17-12-5-3-11(4-6-12)16-13-7-9-18(2)10-8-13/h3-6,13,16H,7-10H2,1-2H3,(H2,15,17,19)
InChIKeyFUFGPZUFQGZGMB-UHFFFAOYSA-N
XLogP1.94
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea 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

1-methyl-3-[4-[(3-methylcyclopentyl)amino]phenyl]urea
CID 64501930
1-methyl-3-[4-(4-methylpiperazine-1-carbonyl)phenyl]urea
CID 118087553
1-[4-(azepan-4-ylamino)phenyl]-3-methylurea
CID 103981461
1-[4-[(3-aminocyclobutyl)amino]phenyl]-3-methylurea
CID 80560889
1-(4-iodophenyl)-3-(1-methylpiperidin-4-yl)urea
CID 47133004
1-amino-N-[4-[(1-methylpiperidin-4-yl)carbamoylamino]phenyl]cyclopropane-1-carboxamide
CID 119890827
1-[4-[1-(methylamino)ethyl]phenyl]-3-(1-methylpiperidin-4-yl)urea
CID 61340940
ethyl 4-[(1-methylpiperidin-4-yl)amino]benzoate
CID 43321731
N-[2-methyl-5-[(1-methylpiperidin-4-yl)amino]phenyl]acetamide
CID 43735881
1-amino-N-[4-[(1-methylpiperidin-4-yl)carbamoylamino]phenyl]cyclopentane-1-carboxamide
CID 119890851
1-methyl-3-[4-[(5-methylthiolan-3-yl)amino]phenyl]urea
CID 79942286
1-[4-[(2,3-dimethylcyclohexyl)amino]phenyl]-3-methylurea
CID 64761262

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea?
The IUPAC name of 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea (CID 43744340) is 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea.
What is the SMILES notation for 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea?
The canonical SMILES for 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea is CNC(=O)Nc1ccc(NC2CCN(C)CC2)cc1.
What is the InChIKey of 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea?
The InChIKey is FUFGPZUFQGZGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-15-14(19)17-12-5-3-11(4-6-12)16-13-7-9-18(2)10-8-13/h3-6,13,16H,7-10H2,1-2H3,(H2,15,17,19).
What are the key properties of 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea?
1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea has a molecular weight of 262.36 g/mol, XLogP of 1.94, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[4-[(1-methylpiperidin-4-yl)amino]phenyl]urea is sourced from PubChem (CID 43744340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).