ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate

C12H16N2O2 — CID 60665020

IUPACethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate
SMILESCCOC(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C12H16N2O2/c1-2-16-12(15)14(11-6-7-11)9-10-5-3-4-8-13-10/h3-5,8,11H,2,6-7,9H2,1H3
InChIKeyLTPTWOVXLBQEQS-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.20
Rot. Bonds4

About ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate

ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate (PubChem CID 60665020) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate.

Molecular Properties

Compound Nameethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate
PubChem CID60665020
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Nameethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate
SMILESCCOC(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C12H16N2O2/c1-2-16-12(15)14(11-6-7-11)9-10-5-3-4-8-13-10/h3-5,8,11H,2,6-7,9H2,1H3
InChIKeyLTPTWOVXLBQEQS-UHFFFAOYSA-N
XLogP2.20
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-(pyridin-2-ylmethyl)propanamide
CID 60668331
N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide
CID 79281792
3-amino-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 62670174
2-amino-N-cyclopropyl-3-methyl-N-(pyridin-2-ylmethyl)butanamide
CID 54869781
cis-(1R,2S)-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 94822499
2-bromo-N-cyclopropyl-N-(pyridin-2-ylmethyl)propanamide
CID 107904243
N-cyclopropyl-3-(cyclopropylamino)-N-(pyridin-2-ylmethyl)propanamide
CID 54869688
2-amino-N-cyclopropyl-3,3-dimethyl-N-(pyridin-2-ylmethyl)butanamide
CID 76895282
2-amino-N-cyclopropyl-6-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 61113549
ethyl N-[(2-aminophenyl)methyl]-N-cyclopropylcarbamate
CID 43460945
4-amino-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)butanamide
CID 80543102
2-amino-N-[2-[cyclopropyl(pyridin-2-ylmethyl)amino]-2-oxoethyl]acetamide
CID 54869689

Frequently Asked Questions

What is the IUPAC name of ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate?
The IUPAC name of ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate (CID 60665020) is ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate.
What is the SMILES notation for ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate?
The canonical SMILES for ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate is CCOC(=O)N(Cc1ccccn1)C1CC1.
What is the InChIKey of ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate?
The InChIKey is LTPTWOVXLBQEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-2-16-12(15)14(11-6-7-11)9-10-5-3-4-8-13-10/h3-5,8,11H,2,6-7,9H2,1H3.
What are the key properties of ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate?
ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate has a molecular weight of 220.27 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate is sourced from PubChem (CID 60665020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).