1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide

C15H25N3O2 — CID 53015787

IUPAC1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide
SMILESCC(C)NC(=O)C1=CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C15H25N3O2/c1-11(2)16-14(19)12-7-9-18(10-8-12)15(20)17-13-5-3-4-6-13/h7,11,13H,3-6,8-10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyXVDHKIVBBFPPEQ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.80
Rot. Bonds3

About 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide

1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide (PubChem CID 53015787) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide
PubChem CID53015787
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide
SMILESCC(C)NC(=O)C1=CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C15H25N3O2/c1-11(2)16-14(19)12-7-9-18(10-8-12)15(20)17-13-5-3-4-6-13/h7,11,13H,3-6,8-10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyXVDHKIVBBFPPEQ-UHFFFAOYSA-N
XLogP1.80
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide (CID 53015787) is 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide is CC(C)NC(=O)C1=CCN(C(=O)NC2CCCC2)CC1.
What is the InChIKey of 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide?
The InChIKey is XVDHKIVBBFPPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11(2)16-14(19)12-7-9-18(10-8-12)15(20)17-13-5-3-4-6-13/h7,11,13H,3-6,8-10H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide?
1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide has a molecular weight of 279.38 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopentyl-4-N-propan-2-yl-3,6-dihydro-2H-pyridine-1,4-dicarboxamide is sourced from PubChem (CID 53015787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).