benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate

C16H16N2O2 — CID 110723115

IUPACbenzyl N-cyclopropyl-N-pyridin-2-ylcarbamate
SMILESO=C(OCc1ccccc1)N(c1ccccn1)C1CC1
InChIInChI=1S/C16H16N2O2/c19-16(20-12-13-6-2-1-3-7-13)18(14-9-10-14)15-8-4-5-11-17-15/h1-8,11,14H,9-10,12H2
InChIKeyLCCRZAPQIANXOV-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.39
Rot. Bonds4

About benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate

benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate (PubChem CID 110723115) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate.

Molecular Properties

Compound Namebenzyl N-cyclopropyl-N-pyridin-2-ylcarbamate
PubChem CID110723115
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Namebenzyl N-cyclopropyl-N-pyridin-2-ylcarbamate
SMILESO=C(OCc1ccccc1)N(c1ccccn1)C1CC1
InChIInChI=1S/C16H16N2O2/c19-16(20-12-13-6-2-1-3-7-13)18(14-9-10-14)15-8-4-5-11-17-15/h1-8,11,14H,9-10,12H2
InChIKeyLCCRZAPQIANXOV-UHFFFAOYSA-N
XLogP3.39
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylcarbamate
CID 21496451
benzyl N-(4-methylcyclohexyl)-N-phenylcarbamate
CID 71093991
benzyl N-cyclopropyl-N-(3H-imidazo[4,5-c]pyridin-2-yl)carbamate
CID 123335824
benzyl N-cyclopropyl-N-propylcarbamate
CID 130159300
(E)-N-cyclohexyl-3-phenyl-N-pyridin-2-ylprop-2-enamide
CID 800217
2-[cyclopropyl(pyridin-2-yl)amino]acetic acid
CID 82372467
benzyl N-(4-aminocyclohexyl)-N-methylcarbamate
CID 91599052
tert-butyl N-(4-ethenylcyclohexyl)-N-pyridin-2-ylcarbamate
CID 134394425
N-cyclopropyl-2-(4-methylphenoxy)-N-pyridin-2-ylacetamide
CID 110723109
N-(1,1-dioxothiolan-3-yl)-2-phenyl-N-pyridin-2-ylacetamide
CID 102566160
benzyl N-[(1R,3R,4S)-3,4-dihydroxycyclohexyl]-N-methylcarbamate
CID 67475983
benzyl 2-[6-[cyclopropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-pyridinyl]piperidine-1-carboxylate
CID 102541138

Frequently Asked Questions

What is the IUPAC name of benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate?
The IUPAC name of benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate (CID 110723115) is benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate.
What is the SMILES notation for benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate?
The canonical SMILES for benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate is O=C(OCc1ccccc1)N(c1ccccn1)C1CC1.
What is the InChIKey of benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate?
The InChIKey is LCCRZAPQIANXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-16(20-12-13-6-2-1-3-7-13)18(14-9-10-14)15-8-4-5-11-17-15/h1-8,11,14H,9-10,12H2.
What are the key properties of benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate?
benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate has a molecular weight of 268.32 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-cyclopropyl-N-pyridin-2-ylcarbamate is sourced from PubChem (CID 110723115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).