N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide

C19H25N5O2 — CID 53156927

IUPACN-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(-n2cnc(C(=O)N3CC(C)CC(C)C3)c2)nc1
InChIInChI=1S/C19H25N5O2/c1-4-18(25)22-15-5-6-17(20-8-15)24-11-16(21-12-24)19(26)23-9-13(2)7-14(3)10-23/h5-6,8,11-14H,4,7,9-10H2,1-3H3,(H,22,25)
InChIKeyJRZLXROZGPEXOE-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.73
Rot. Bonds4

About N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide

N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide (PubChem CID 53156927) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide
PubChem CID53156927
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(-n2cnc(C(=O)N3CC(C)CC(C)C3)c2)nc1
InChIInChI=1S/C19H25N5O2/c1-4-18(25)22-15-5-6-17(20-8-15)24-11-16(21-12-24)19(26)23-9-13(2)7-14(3)10-23/h5-6,8,11-14H,4,7,9-10H2,1-3H3,(H,22,25)
InChIKeyJRZLXROZGPEXOE-UHFFFAOYSA-N
XLogP2.73
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide?
The IUPAC name of N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide (CID 53156927) is N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide.
What is the SMILES notation for N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide?
The canonical SMILES for N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide is CCC(=O)Nc1ccc(-n2cnc(C(=O)N3CC(C)CC(C)C3)c2)nc1.
What is the InChIKey of N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide?
The InChIKey is JRZLXROZGPEXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-4-18(25)22-15-5-6-17(20-8-15)24-11-16(21-12-24)19(26)23-9-13(2)7-14(3)10-23/h5-6,8,11-14H,4,7,9-10H2,1-3H3,(H,22,25).
What are the key properties of N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide?
N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide has a molecular weight of 355.44 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide is sourced from PubChem (CID 53156927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).