(2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide

C19H26N4O — CID 119858502

About (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide

(2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide (PubChem CID 119858502) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide.

Molecular Properties

• Compound Name: (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide
• PubChem CID: 119858502
• Molecular Formula: C19H26N4O
• Molecular Weight: 326.44 g/mol
• Exact Mass: 326.21
• IUPAC Name: (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide
• SMILES: CC(C)C[C@H](N)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1
• InChI: InChI=1S/C19H26N4O/c1-13(2)11-17(20)19(24)22-15-8-6-14(7-9-15)18-21-12-16-5-3-4-10-23(16)18/h6-9,12-13,17H,3-5,10-11,20H2,1-2H3,(H,22,24)/t17-/m0/s1
• InChIKey: WXSKITRKRJCRKC-KRWDZBQOSA-N
• XLogP: 3.20
• TPSA: 72.94 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	326.44
LogP ≤ 5	3.20
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide?

The IUPAC name of (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide (CID 119858502) is (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide.

What is the SMILES notation for (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide?

The canonical SMILES for (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide is CC(C)C[C@H](N)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1.

What is the InChIKey of (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide?

The InChIKey is WXSKITRKRJCRKC-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H26N4O/c1-13(2)11-17(20)19(24)22-15-8-6-14(7-9-15)18-21-12-16-5-3-4-10-23(16)18/h6-9,12-13,17H,3-5,10-11,20H2,1-2H3,(H,22,24)/t17-/m0/s1.

What are the key properties of (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide?

(2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide has a molecular weight of 326.44 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-amino-4-methyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pentanamide is sourced from PubChem (CID 119858502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).