N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide

C13H20N4O — CID 107374841

IUPACN-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cnc(NC)cn1
InChIInChI=1S/C13H20N4O/c1-3-6-17(9-10-4-5-10)13(18)11-7-16-12(14-2)8-15-11/h7-8,10H,3-6,9H2,1-2H3,(H,14,16)
InChIKeyNNQASXKOOBRPBZ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.78
Rot. Bonds6

About N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide

N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide (PubChem CID 107374841) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide
PubChem CID107374841
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cnc(NC)cn1
InChIInChI=1S/C13H20N4O/c1-3-6-17(9-10-4-5-10)13(18)11-7-16-12(14-2)8-15-11/h7-8,10H,3-6,9H2,1-2H3,(H,14,16)
InChIKeyNNQASXKOOBRPBZ-UHFFFAOYSA-N
XLogP1.78
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374839
N-ethyl-5-(methylamino)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374809
N-ethyl-5-hydrazinyl-N-propylpyrazine-2-carboxamide
CID 107378064
5-(methylamino)-N,N-bis(2-methylpropyl)pyrazine-2-carboxamide
CID 107374736
N-cyclopentyl-N-(2-hydroxyethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107375030
N-(cyclopropylmethyl)-5-(N'-hydroxycarbamimidoyl)-N-propylpyridine-2-carboxamide
CID 77005162
N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374972
N-(cyclopropylmethyl)-5-(methylamino)-2-propan-2-yl-N-propylpyrimidine-4-carboxamide
CID 62179991
N-(cyclopropylmethyl)-5-(ethylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107375257
N-(cyclopropylmethyl)-5-(methylamino)-N-propyl-1,3,4-thiadiazole-2-carboxamide
CID 80615496
N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107374443
5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide
CID 109276273

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide (CID 107374841) is N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide is CCCN(CC1CC1)C(=O)c1cnc(NC)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide?
The InChIKey is NNQASXKOOBRPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-3-6-17(9-10-4-5-10)13(18)11-7-16-12(14-2)8-15-11/h7-8,10H,3-6,9H2,1-2H3,(H,14,16).
What are the key properties of N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide?
N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide is sourced from PubChem (CID 107374841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).