N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide

C16H26N4O — CID 26336154

IUPACN-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide
SMILESCn1cc(CN2CCC(CCC(=O)NC3CC3)CC2)cn1
InChIInChI=1S/C16H26N4O/c1-19-11-14(10-17-19)12-20-8-6-13(7-9-20)2-5-16(21)18-15-3-4-15/h10-11,13,15H,2-9,12H2,1H3,(H,18,21)
InChIKeySDFNXFRMOVCKKC-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.69
Rot. Bonds6

About N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide

N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide (PubChem CID 26336154) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide
PubChem CID26336154
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide
SMILESCn1cc(CN2CCC(CCC(=O)NC3CC3)CC2)cn1
InChIInChI=1S/C16H26N4O/c1-19-11-14(10-17-19)12-20-8-6-13(7-9-20)2-5-16(21)18-15-3-4-15/h10-11,13,15H,2-9,12H2,1H3,(H,18,21)
InChIKeySDFNXFRMOVCKKC-UHFFFAOYSA-N
XLogP1.69
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide (CID 26336154) is N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide is Cn1cc(CN2CCC(CCC(=O)NC3CC3)CC2)cn1.
What is the InChIKey of N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide?
The InChIKey is SDFNXFRMOVCKKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-19-11-14(10-17-19)12-20-8-6-13(7-9-20)2-5-16(21)18-15-3-4-15/h10-11,13,15H,2-9,12H2,1H3,(H,18,21).
What are the key properties of N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide?
N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide has a molecular weight of 290.41 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]propanamide is sourced from PubChem (CID 26336154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).