N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide

C11H18N4O — CID 107374443

IUPACN-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(NC)cn1)C(C)C
InChIInChI=1S/C11H18N4O/c1-5-15(8(2)3)11(16)9-6-14-10(12-4)7-13-9/h6-8H,5H2,1-4H3,(H,12,14)
InChIKeyBTHWOTUNSIZYFZ-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.39
Rot. Bonds4

About N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide

N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide (PubChem CID 107374443) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
PubChem CID107374443
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(NC)cn1)C(C)C
InChIInChI=1S/C11H18N4O/c1-5-15(8(2)3)11(16)9-6-14-10(12-4)7-13-9/h6-8H,5H2,1-4H3,(H,12,14)
InChIKeyBTHWOTUNSIZYFZ-UHFFFAOYSA-N
XLogP1.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(methylamino)-N,N-bis(2-methylpropyl)pyrazine-2-carboxamide
CID 107374736
N-(1-methoxypropan-2-yl)-N-methyl-5-(methylamino)pyrazine-2-carboxamide
CID 107374798
N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide
CID 107375250
5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide
CID 107375458
N-(cyclopropylmethyl)-5-(ethylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107375257
N-ethyl-N-propan-2-ylisoquinoline-3-carboxamide
CID 67428149
N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide
CID 107374841
5-(methylamino)-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 113436082
5-(methylamino)-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107375550
N-(2-acetamidoethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374531
5-(methylamino)-N-(1-methylsulfanylpropan-2-yl)pyrazine-2-carboxamide
CID 107376850
N-ethyl-5-(methylamino)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374809

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide?
The IUPAC name of N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide (CID 107374443) is N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide?
The canonical SMILES for N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide is CCN(C(=O)c1cnc(NC)cn1)C(C)C.
What is the InChIKey of N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide?
The InChIKey is BTHWOTUNSIZYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-5-15(8(2)3)11(16)9-6-14-10(12-4)7-13-9/h6-8H,5H2,1-4H3,(H,12,14).
What are the key properties of N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide?
N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 107374443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).