N-(1-methylpiperidine-3-carbonyl)carbamate

C8H13N2O3- — CID 21202727

IUPACN-(1-methylpiperidine-3-carbonyl)carbamate
SMILESCN1CCCC(C(=O)NC(=O)[O-])C1
InChIInChI=1S/C8H14N2O3/c1-10-4-2-3-6(5-10)7(11)9-8(12)13/h6H,2-5H2,1H3,(H,9,11)(H,12,13)/p-1
InChIKeyRRDISTJHSVZLQR-UHFFFAOYSA-M
MW185.20 g/mol
LogP-1.21
Rot. Bonds1

About N-(1-methylpiperidine-3-carbonyl)carbamate

N-(1-methylpiperidine-3-carbonyl)carbamate (PubChem CID 21202727) has the molecular formula C8H13N2O3- and a molecular weight of 185.20 g/mol. Its IUPAC name is N-(1-methylpiperidine-3-carbonyl)carbamate.

Molecular Properties

Compound NameN-(1-methylpiperidine-3-carbonyl)carbamate
PubChem CID21202727
Molecular FormulaC8H13N2O3-
Molecular Weight185.20 g/mol
Exact Mass185.09
IUPAC NameN-(1-methylpiperidine-3-carbonyl)carbamate
SMILESCN1CCCC(C(=O)NC(=O)[O-])C1
InChIInChI=1S/C8H14N2O3/c1-10-4-2-3-6(5-10)7(11)9-8(12)13/h6H,2-5H2,1H3,(H,9,11)(H,12,13)/p-1
InChIKeyRRDISTJHSVZLQR-UHFFFAOYSA-M
XLogP-1.21
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.20
LogP ≤ 5-1.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-methylpiperidine-3-carbonyl)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

(3R)-N-cyclohexyl-1-methylpiperidine-3-carboxamide
CID 95183728
1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 12514711
(3S)-1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 67923100
1-methylpiperidine-3-carbothioic S-acid
CID 116918903
(3S)-N-(1-adamantyl)-1-methylpiperidine-3-carboxamide
CID 99970201
(3S)-1-methyl-N-(3-pyrrolidin-1-ylpropyl)piperidine-3-carboxamide
CID 95903528
3-[(1-methylpiperidine-3-carbonyl)amino]butanoic acid
CID 53216017
1-[(3R)-1-methylpiperidin-3-yl]propan-1-one
CID 96635007
2,2-dimethyl-1-[(3R)-1-methylpiperidin-3-yl]propan-1-one
CID 155222976
3-chloro-1-(1-methylpiperidin-3-yl)propane-1,2-dione
CID 116822710
1-(1-methylpiperidin-3-yl)-2-sulfanylethanone
CID 116829941
(3-aminopiperidin-1-yl)-(1-methylpiperidin-3-yl)methanone
CID 121200535

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidine-3-carbonyl)carbamate?
The IUPAC name of N-(1-methylpiperidine-3-carbonyl)carbamate (CID 21202727) is N-(1-methylpiperidine-3-carbonyl)carbamate.
What is the SMILES notation for N-(1-methylpiperidine-3-carbonyl)carbamate?
The canonical SMILES for N-(1-methylpiperidine-3-carbonyl)carbamate is CN1CCCC(C(=O)NC(=O)[O-])C1.
What is the InChIKey of N-(1-methylpiperidine-3-carbonyl)carbamate?
The InChIKey is RRDISTJHSVZLQR-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H14N2O3/c1-10-4-2-3-6(5-10)7(11)9-8(12)13/h6H,2-5H2,1H3,(H,9,11)(H,12,13)/p-1.
What are the key properties of N-(1-methylpiperidine-3-carbonyl)carbamate?
N-(1-methylpiperidine-3-carbonyl)carbamate has a molecular weight of 185.20 g/mol, XLogP of -1.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidine-3-carbonyl)carbamate is sourced from PubChem (CID 21202727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).