6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide

C14H14ClN3O2 — CID 106551139

IUPAC6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide
SMILESCc1ccc(CN(C(=O)c2cncc(Cl)n2)C2CC2)o1
InChIInChI=1S/C14H14ClN3O2/c1-9-2-5-11(20-9)8-18(10-3-4-10)14(19)12-6-16-7-13(15)17-12/h2,5-7,10H,3-4,8H2,1H3
InChIKeyPFKYELAAYJWQMZ-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.84
Rot. Bonds4

About 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide

6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide (PubChem CID 106551139) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide
PubChem CID106551139
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide
SMILESCc1ccc(CN(C(=O)c2cncc(Cl)n2)C2CC2)o1
InChIInChI=1S/C14H14ClN3O2/c1-9-2-5-11(20-9)8-18(10-3-4-10)14(19)12-6-16-7-13(15)17-12/h2,5-7,10H,3-4,8H2,1H3
InChIKeyPFKYELAAYJWQMZ-UHFFFAOYSA-N
XLogP2.84
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-cyclopentyl-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 103337342
6-chloro-N-cyclopentyl-N-ethylpyrazine-2-carboxamide
CID 103187282
3-amino-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-1H-1,2,4-triazole-5-carboxamide
CID 62794179
6-chloro-N-cyclopropyl-N-methylpyrazine-2-carboxamide
CID 103187185
3-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60949956
3-chloro-N-cyclopropyl-2,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 63665475
2-bromo-N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 114328211
N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60794855
N-cyclopropyl-4-fluoro-3-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 63213318
3-amino-N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 61108342
N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 60793853
5-bromo-N-cyclopropyl-4-methyl-N-[(5-methylfuran-2-yl)methyl]thiophene-2-carboxamide
CID 79926716

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide (CID 106551139) is 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide is Cc1ccc(CN(C(=O)c2cncc(Cl)n2)C2CC2)o1.
What is the InChIKey of 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is PFKYELAAYJWQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-9-2-5-11(20-9)8-18(10-3-4-10)14(19)12-6-16-7-13(15)17-12/h2,5-7,10H,3-4,8H2,1H3.
What are the key properties of 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide?
6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 106551139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).