methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate

C9H13N3O2 — CID 145083891

IUPACmethyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate
SMILESCCN(C(=O)OC)c1ccnc(N)c1
InChIInChI=1S/C9H13N3O2/c1-3-12(9(13)14-2)7-4-5-11-8(10)6-7/h4-6H,3H2,1-2H3,(H2,10,11)
InChIKeySRSXJMHJNBKTGF-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.26
Rot. Bonds2

About methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate

methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate (PubChem CID 145083891) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate.

Molecular Properties

Compound Namemethyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate
PubChem CID145083891
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Namemethyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate
SMILESCCN(C(=O)OC)c1ccnc(N)c1
InChIInChI=1S/C9H13N3O2/c1-3-12(9(13)14-2)7-4-5-11-8(10)6-7/h4-6H,3H2,1-2H3,(H2,10,11)
InChIKeySRSXJMHJNBKTGF-UHFFFAOYSA-N
XLogP1.26
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-ethyl-N-(3-hydroxyphenyl)carbamate
CID 107734186
(2,3,4,5,6-pentafluorophenyl) N-ethyl-N-(2-methyl-4-pyridinyl)carbamate
CID 87883878
methyl N-ethyl-N-[4-(propylamino)phenyl]carbamate
CID 151199082
methyl N-[4-[5-(aminomethyl)-2-pyridinyl]-3-fluorophenyl]-N-ethylcarbamate
CID 143081927
methyl N-ethyl-N-(4-phenylphenyl)carbamate;hydrochloride
CID 173118829
2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
CID 63180905
4-N-ethyl-4-N-(3-methylphenyl)pyridine-2,4-diamine
CID 113367563
2-amino-N-[2-(diethylamino)ethyl]pyridine-4-carboxamide
CID 62156406
(2-amino-4-pyridinyl)methyl propanoate
CID 166101515
propan-2-yl N-ethyl-N-pyridin-4-ylcarbamate
CID 106934812
3-(2-amino-4-pyridinyl)-1,1-dimethoxypropan-2-one
CID 79492824
2-[(2-amino-4-pyridinyl)methyl-ethylamino]-N-ethylacetamide
CID 62465226

Frequently Asked Questions

What is the IUPAC name of methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate?
The IUPAC name of methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate (CID 145083891) is methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate.
What is the SMILES notation for methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate?
The canonical SMILES for methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate is CCN(C(=O)OC)c1ccnc(N)c1.
What is the InChIKey of methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate?
The InChIKey is SRSXJMHJNBKTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-3-12(9(13)14-2)7-4-5-11-8(10)6-7/h4-6H,3H2,1-2H3,(H2,10,11).
What are the key properties of methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate?
methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate has a molecular weight of 195.22 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-amino-4-pyridinyl)-N-ethylcarbamate is sourced from PubChem (CID 145083891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).