2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide

C19H24N4O2 — CID 75438560

IUPAC2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCC1CC1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1
InChIInChI=1S/C19H24N4O2/c1-13-11-16(13)17-5-4-14(25-17)12-22-7-9-23(10-8-22)19-15(18(20)24)3-2-6-21-19/h2-6,13,16H,7-12H2,1H3,(H2,20,24)
InChIKeyNHVFVQIDACZZGX-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.22
Rot. Bonds5

About 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide

2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide (PubChem CID 75438560) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide
PubChem CID75438560
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCC1CC1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1
InChIInChI=1S/C19H24N4O2/c1-13-11-16(13)17-5-4-14(25-17)12-22-7-9-23(10-8-22)19-15(18(20)24)3-2-6-21-19/h2-6,13,16H,7-12H2,1H3,(H2,20,24)
InChIKeyNHVFVQIDACZZGX-UHFFFAOYSA-N
XLogP2.22
TPSA75.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide?
The IUPAC name of 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide (CID 75438560) is 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide is CC1CC1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1.
What is the InChIKey of 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide?
The InChIKey is NHVFVQIDACZZGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-11-16(13)17-5-4-14(25-17)12-22-7-9-23(10-8-22)19-15(18(20)24)3-2-6-21-19/h2-6,13,16H,7-12H2,1H3,(H2,20,24).
What are the key properties of 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide?
2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperazin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 75438560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).