ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate

C19H24N4O3 — CID 110179570

IUPACethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC2CCOc3cc(C)cc(C)c32)nc1N
InChIInChI=1S/C19H24N4O3/c1-4-25-19(24)22-14-5-6-16(23-18(14)20)21-13-7-8-26-15-10-11(2)9-12(3)17(13)15/h5-6,9-10,13H,4,7-8H2,1-3H3,(H,22,24)(H3,20,21,23)
InChIKeyKCRYVFOYPPDRCC-UHFFFAOYSA-N
MW356.43 g/mol
LogP3.78
Rot. Bonds4

About ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate

ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate (PubChem CID 110179570) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate
PubChem CID110179570
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Nameethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC2CCOc3cc(C)cc(C)c32)nc1N
InChIInChI=1S/C19H24N4O3/c1-4-25-19(24)22-14-5-6-16(23-18(14)20)21-13-7-8-26-15-10-11(2)9-12(3)17(13)15/h5-6,9-10,13H,4,7-8H2,1-3H3,(H,22,24)(H3,20,21,23)
InChIKeyKCRYVFOYPPDRCC-UHFFFAOYSA-N
XLogP3.78
TPSA98.50 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 53.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]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

ethyl N-[2-amino-6-[(5,7-dimethyl-2,3-dihydro-1H-inden-1-yl)amino]-3-pyridinyl]carbamate
CID 110179298
ethyl N-[2-amino-6-[(2,4-dimethylphenyl)methylamino]-3-pyridinyl]carbamate;hydrochloride
CID 45261304
ethyl N-[2-amino-6-[1-(2,4-dimethylphenyl)ethylamino]-3-pyridinyl]carbamate
CID 110179360
ethyl N-[2-amino-6-[(5,7-dimethyl-2,3-dihydro-1H-inden-1-yl)amino]pyridin-1-ium-3-yl]carbamate chloride
CID 136821511
ethyl N-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)carbamate
CID 110778029
ethyl N-[2-amino-6-[(2,6-dimethylphenyl)methylamino]-3-pyridinyl]carbamate;hydrochloride
CID 45261324
ethyl N-[2-amino-6-(furan-2-ylmethylamino)-3-pyridinyl]carbamate
CID 110178948
ethyl N-[2-amino-6-[(4-fluorocyclohexa-1,5-dien-1-yl)methylamino]-3-pyridinyl]carbamate
CID 123284761
ethyl N-[2-amino-6-[(2,4-difluorophenyl)methylamino]-3-pyridinyl]carbamate
CID 10426258
ethyl N-[3-amino-6-[(2,4,6-trimethylphenyl)methylamino]-2-pyridinyl]carbamate
CID 110179683
ethane;ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridinyl]carbamate
CID 153394509
2-N-(3,4-dihydro-2H-chromen-4-yl)-6-ethoxypyridine-2,5-diamine
CID 62365052

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate?
The IUPAC name of ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate (CID 110179570) is ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate.
What is the SMILES notation for ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate?
The canonical SMILES for ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate is CCOC(=O)Nc1ccc(NC2CCOc3cc(C)cc(C)c32)nc1N.
What is the InChIKey of ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate?
The InChIKey is KCRYVFOYPPDRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-4-25-19(24)22-14-5-6-16(23-18(14)20)21-13-7-8-26-15-10-11(2)9-12(3)17(13)15/h5-6,9-10,13H,4,7-8H2,1-3H3,(H,22,24)(H3,20,21,23).
What are the key properties of ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate?
ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate has a molecular weight of 356.43 g/mol, XLogP of 3.78, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-amino-6-[(5,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)amino]-3-pyridinyl]carbamate is sourced from PubChem (CID 110179570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).