Cbz-Ala-Gly-Pro-OMe

Name: Cbz-Ala-Gly-Pro-OMe — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₉H₂₅N₃O₆ — CID 155545723

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACmethyl (2S)-1-[2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]pyrrolidine-2-carboxylate

SMILESCOC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)OCc1ccccc1

InChIInChI=1S/C19H25N3O6/c1-13(21-19(26)28-12-14-7-4-3-5-8-14)17(24)20-11-16(23)22-10-6-9-15(22)18(25)27-2/h3-5,7-8,13,15H,6,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,15-/m0/s1

InChIKeyYMPKIQOJDRNKEG-ZFWWWQNUSA-N

MW391.42 g/mol

LogP0.58

Rot. Bonds7

About Cbz-Ala-Gly-Pro-OMe

Cbz-Ala-Gly-Pro-OMe (PubChem CID 155545723) has the molecular formula C₁₉H₂₅N₃O₆ and a molecular weight of 391.42 g/mol. Its IUPAC name is methyl (2S)-1-[2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]pyrrolidine-2-carboxylate.

Molecular Properties

Compound Name	Cbz-Ala-Gly-Pro-OMe
PubChem CID	155545723
Molecular Formula	C₁₉H₂₅N₃O₆
Molecular Weight	391.42 g/mol
Exact Mass	391.17
IUPAC Name	methyl (2S)-1-[2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]pyrrolidine-2-carboxylate
SMILES	COC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)OCc1ccccc1
InChI	InChI=1S/C19H25N3O6/c1-13(21-19(26)28-12-14-7-4-3-5-8-14)17(24)20-11-16(23)22-10-6-9-15(22)18(25)27-2/h3-5,7-8,13,15H,6,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,15-/m0/s1
InChIKey	YMPKIQOJDRNKEG-ZFWWWQNUSA-N
XLogP	0.58
TPSA	114.04 Å²
H-Bond Donors	2
H-Bond Acceptors	6
Rotatable Bonds	7
Heavy Atoms	28
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	391.42
LogP ≤ 5	0.58
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of Cbz-Ala-Gly-Pro-OMe?

The IUPAC name of Cbz-Ala-Gly-Pro-OMe (CID 155545723) is methyl (2S)-1-[2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]pyrrolidine-2-carboxylate.

What is the SMILES notation for Cbz-Ala-Gly-Pro-OMe?

The canonical SMILES for Cbz-Ala-Gly-Pro-OMe is COC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)OCc1ccccc1.

What is the InChIKey of Cbz-Ala-Gly-Pro-OMe?

The InChIKey is YMPKIQOJDRNKEG-ZFWWWQNUSA-N. The full InChI is InChI=1S/C19H25N3O6/c1-13(21-19(26)28-12-14-7-4-3-5-8-14)17(24)20-11-16(23)22-10-6-9-15(22)18(25)27-2/h3-5,7-8,13,15H,6,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,15-/m0/s1.

What are the key properties of Cbz-Ala-Gly-Pro-OMe?

Cbz-Ala-Gly-Pro-OMe has a molecular weight of 391.42 g/mol, XLogP of 0.58, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Cbz-Ala-Gly-Pro-OMe is sourced from PubChem (CID 155545723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 155545723 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.