methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate

C14H20N4O3 — CID 60942471

IUPACmethyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate
SMILESCOC(=O)Nc1cccc(NC2CCN(C(N)=O)CC2)c1
InChIInChI=1S/C14H20N4O3/c1-21-14(20)17-12-4-2-3-11(9-12)16-10-5-7-18(8-6-10)13(15)19/h2-4,9-10,16H,5-8H2,1H3,(H2,15,19)(H,17,20)
InChIKeyUUQNQRLEVVBGBU-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.82
Rot. Bonds3

About methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate

methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate (PubChem CID 60942471) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate.

Molecular Properties

Compound Namemethyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate
PubChem CID60942471
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Namemethyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate
SMILESCOC(=O)Nc1cccc(NC2CCN(C(N)=O)CC2)c1
InChIInChI=1S/C14H20N4O3/c1-21-14(20)17-12-4-2-3-11(9-12)16-10-5-7-18(8-6-10)13(15)19/h2-4,9-10,16H,5-8H2,1H3,(H2,15,19)(H,17,20)
InChIKeyUUQNQRLEVVBGBU-UHFFFAOYSA-N
XLogP1.82
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate 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

methyl N-[3-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]carbamate
CID 60944093
methyl N-[3-[(1-methylazepan-4-yl)amino]phenyl]carbamate
CID 65070487
4-[3-(dimethylamino)anilino]piperidine-1-carboxamide
CID 115376468
4-(3-methylsulfanylanilino)piperidine-1-carboxamide
CID 43757325
4-[3-[(dimethylamino)methyl]anilino]piperidine-1-carboxamide
CID 43782212
4-[3-(difluoromethoxy)anilino]piperidine-1-carboxamide
CID 43783712
methyl N-[3-[(3-aminocyclohexyl)amino]phenyl]carbamate
CID 79459255
4-(3-chloro-4-methoxyanilino)piperidine-1-carboxamide
CID 43758136
methyl N-[3-[(3-methylcyclohexyl)amino]phenyl]carbamate
CID 54864154
4-(3-hydroxy-4-methylanilino)piperidine-1-carboxamide
CID 107700221
N-[3-(cyclopropylamino)phenyl]acetamide
CID 45119286
4-(3-bromo-5-methoxyanilino)piperidine-1-carboxamide
CID 82858235

Frequently Asked Questions

What is the IUPAC name of methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate?
The IUPAC name of methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate (CID 60942471) is methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate.
What is the SMILES notation for methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate?
The canonical SMILES for methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate is COC(=O)Nc1cccc(NC2CCN(C(N)=O)CC2)c1.
What is the InChIKey of methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate?
The InChIKey is UUQNQRLEVVBGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-21-14(20)17-12-4-2-3-11(9-12)16-10-5-7-18(8-6-10)13(15)19/h2-4,9-10,16H,5-8H2,1H3,(H2,15,19)(H,17,20).
What are the key properties of methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate?
methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate has a molecular weight of 292.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[3-[(1-carbamoylpiperidin-4-yl)amino]phenyl]carbamate is sourced from PubChem (CID 60942471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).