N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide

C19H24N4O3 — CID 133442683

IUPACN-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide
SMILESCC(C)Oc1nccnc1NCc1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C19H24N4O3/c1-13(2)26-19-17(20-8-9-21-19)22-12-14-5-3-6-15(11-14)23-18(24)16-7-4-10-25-16/h3,5-6,8-9,11,13,16H,4,7,10,12H2,1-2H3,(H,20,22)(H,23,24)
InChIKeyVLDKDAMCWMJHQM-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.99
Rot. Bonds7

About N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide

N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide (PubChem CID 133442683) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide
PubChem CID133442683
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide
SMILESCC(C)Oc1nccnc1NCc1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C19H24N4O3/c1-13(2)26-19-17(20-8-9-21-19)22-12-14-5-3-6-15(11-14)23-18(24)16-7-4-10-25-16/h3,5-6,8-9,11,13,16H,4,7,10,12H2,1-2H3,(H,20,22)(H,23,24)
InChIKeyVLDKDAMCWMJHQM-UHFFFAOYSA-N
XLogP2.99
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide with MolForge

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Related Compounds

3-methyl-N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]butanamide
CID 133468788
(2R)-N-[3-[[(3,5-dichloro-2-pyridinyl)amino]methyl]phenyl]oxolane-2-carboxamide
CID 100663858
(2S)-N-[3-[[(3-nitro-2-pyridinyl)amino]methyl]phenyl]oxolane-2-carboxamide
CID 94825831
N-[3-[(2-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 55742217
N-[3-(methylaminomethyl)phenyl]oxolane-2-carboxamide
CID 43601839
N-ethyl-4-[[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]methylamino]pyridine-2-carboxamide
CID 97315172
N-[3-[[[(2R)-2-aminopropanoyl]amino]methyl]phenyl]oxolane-2-carboxamide;hydrochloride
CID 119305205
N-[3-[(1H-pyrazolo[5,4-d]pyrimidin-4-ylamino)methyl]phenyl]oxolane-2-carboxamide
CID 133274136
N-[3-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]methyl]phenyl]oxolane-2-carboxamide
CID 47982074
6-[[3-(oxolane-2-carbonylamino)phenyl]methylamino]pyridine-2-carboxylic acid
CID 122047903
N-[3-[[(2-ethylquinolin-4-yl)amino]methyl]phenyl]oxolane-2-carboxamide
CID 133404937
N-[3-[[(N'-methyl-N-propan-2-ylcarbamimidoyl)amino]methyl]phenyl]oxolane-2-carboxamide;hydroiodide
CID 111124506

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide (CID 133442683) is N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide is CC(C)Oc1nccnc1NCc1cccc(NC(=O)C2CCCO2)c1.
What is the InChIKey of N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide?
The InChIKey is VLDKDAMCWMJHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-13(2)26-19-17(20-8-9-21-19)22-12-14-5-3-6-15(11-14)23-18(24)16-7-4-10-25-16/h3,5-6,8-9,11,13,16H,4,7,10,12H2,1-2H3,(H,20,22)(H,23,24).
What are the key properties of N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide?
N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 2.99, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 133442683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).