N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide

C17H26N4O — CID 17447495

IUPACN-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1cnccn1
InChIInChI=1S/C17H26N4O/c22-16(15-13-18-9-10-19-15)20-14-17(7-3-1-4-8-17)21-11-5-2-6-12-21/h9-10,13H,1-8,11-12,14H2,(H,20,22)
InChIKeyLJPMMYPFCIDFLX-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.40
Rot. Bonds4

About N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide

N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide (PubChem CID 17447495) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide
PubChem CID17447495
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1cnccn1
InChIInChI=1S/C17H26N4O/c22-16(15-13-18-9-10-19-15)20-14-17(7-3-1-4-8-17)21-11-5-2-6-12-21/h9-10,13H,1-8,11-12,14H2,(H,20,22)
InChIKeyLJPMMYPFCIDFLX-UHFFFAOYSA-N
XLogP2.40
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-piperidin-1-ylcyclohexyl)methyl]-3-pyrazin-2-ylprop-2-enamide
CID 91942523
N-[[1-(hydroxymethyl)cyclobutyl]methyl]pyrazine-2-carboxamide
CID 91954428
2-pyridin-3-yl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]acetamide
CID 91780791
N-[[1-(morpholin-4-ylmethyl)cyclopropyl]methyl]pyrazine-2-carboxamide
CID 91957397
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]pyrazine-2-carboxamide
CID 47042253
N-[(4-hydroxyoxan-4-yl)methyl]pyrazine-2-carboxamide
CID 79039942
4-chloro-N-[(4-piperidin-1-yloxan-4-yl)methyl]pyridine-2-carboxamide
CID 136524945
2-amino-6-methyl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-4-carboxamide
CID 91771967
2,4-dioxo-N-[(1-piperidin-1-ylcyclohexyl)methyl]-1H-pyrimidine-6-carboxamide
CID 56711486
N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide
CID 9291996
N-[1-(hydroxymethyl)cyclopentyl]pyrazine-2-carboxamide
CID 62519593
6-oxo-1-phenyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]pyridazine-3-carboxamide
CID 134005162

Frequently Asked Questions

What is the IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide (CID 17447495) is N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide is O=C(NCC1(N2CCCCC2)CCCCC1)c1cnccn1.
What is the InChIKey of N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide?
The InChIKey is LJPMMYPFCIDFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c22-16(15-13-18-9-10-19-15)20-14-17(7-3-1-4-8-17)21-11-5-2-6-12-21/h9-10,13H,1-8,11-12,14H2,(H,20,22).
What are the key properties of N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide?
N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 17447495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).