5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide

C14H23N5O — CID 107374811

IUPAC5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCC2CCN(C(C)C)C2)cn1
InChIInChI=1S/C14H23N5O/c1-10(2)19-5-4-11(9-19)6-18-14(20)12-7-17-13(15-3)8-16-12/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17)(H,18,20)
InChIKeyPYMLYIFBXSXEBD-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.98
Rot. Bonds5

About 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide

5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide (PubChem CID 107374811) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide
PubChem CID107374811
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCC2CCN(C(C)C)C2)cn1
InChIInChI=1S/C14H23N5O/c1-10(2)19-5-4-11(9-19)6-18-14(20)12-7-17-13(15-3)8-16-12/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17)(H,18,20)
InChIKeyPYMLYIFBXSXEBD-UHFFFAOYSA-N
XLogP0.98
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridazine-3-carboxamide
CID 61216005
4-methyl-2-propan-2-yl-N-[[(3S)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyrimidine-5-carboxamide
CID 95204324
N-[(1-ethylpyrrolidin-3-yl)methyl]-5-hydrazinylpyrazine-2-carboxamide
CID 107377516
6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide
CID 62238644
5-(methylamino)-N-(2-piperidin-1-ylpropyl)pyrazine-2-carboxamide
CID 107375177
4-amino-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1H-pyrazole-5-carboxamide
CID 63103599
4-bromo-1-propan-2-yl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrrole-2-carboxamide
CID 61208730
6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 95591154
4-amino-6-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 81243278
2-[4-[(1-propan-2-ylpyrrolidin-3-yl)methylcarbamoyl]triazol-1-yl]acetic acid
CID 66290632
2-[(1-propan-2-ylpyrrolidin-3-yl)methylcarbamoyl]pyridine-3-carboxylic acid
CID 63616085
5-amino-1-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazole-4-carboxamide
CID 115330698

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide (CID 107374811) is 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide is CNc1cnc(C(=O)NCC2CCN(C(C)C)C2)cn1.
What is the InChIKey of 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is PYMLYIFBXSXEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-10(2)19-5-4-11(9-19)6-18-14(20)12-7-17-13(15-3)8-16-12/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17)(H,18,20).
What are the key properties of 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide?
5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 107374811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).