(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide

C10H23N3O2 — CID 57077113

IUPAC(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide
SMILESCC(C)[C@H](CO)NC(=O)[C@H](N)CCCN
InChIInChI=1S/C10H23N3O2/c1-7(2)9(6-14)13-10(15)8(12)4-3-5-11/h7-9,14H,3-6,11-12H2,1-2H3,(H,13,15)/t8-,9+/m1/s1
InChIKeyNLNGYNWSCNADKD-BDAKNGLRSA-N
MW217.31 g/mol
LogP-0.81
Rot. Bonds7

About (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide

(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide (PubChem CID 57077113) has the molecular formula C10H23N3O2 and a molecular weight of 217.31 g/mol. Its IUPAC name is (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide.

Molecular Properties

Compound Name(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide
PubChem CID57077113
Molecular FormulaC10H23N3O2
Molecular Weight217.31 g/mol
Exact Mass217.18
IUPAC Name(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide
SMILESCC(C)[C@H](CO)NC(=O)[C@H](N)CCCN
InChIInChI=1S/C10H23N3O2/c1-7(2)9(6-14)13-10(15)8(12)4-3-5-11/h7-9,14H,3-6,11-12H2,1-2H3,(H,13,15)/t8-,9+/m1/s1
InChIKeyNLNGYNWSCNADKD-BDAKNGLRSA-N
XLogP-0.81
TPSA101.37 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 5-0.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

IV
CID 435949
Ile-Val
CID 449407
Leucylvaline
CID 352038
L-Prolyl-L-valine
CID 152307
Pro-val
CID 142984
(2S)-2-(((2S,4S)-4,5-Diamino-2-Hydroxypentanoyl)Amino)-4-Methylpentanamide
CID 76317397
Leu-Val
CID 6993116
(3S,6S)-3-(hydroxymethyl)-6-(2-methylpropyl)piperazine-2,5-dione
CID 57396597
Gln-Val
CID 57262456
L-Seryl-L-leucyl-L-valine
CID 101769071
(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]pentanoyl]amino]-3-methylbutanoic acid
CID 10521445
(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]butanoic acid
CID 10831362

Frequently Asked Questions

What is the IUPAC name of (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The IUPAC name of (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide (CID 57077113) is (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide.
What is the SMILES notation for (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The canonical SMILES for (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide is CC(C)[C@H](CO)NC(=O)[C@H](N)CCCN.
What is the InChIKey of (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The InChIKey is NLNGYNWSCNADKD-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H23N3O2/c1-7(2)9(6-14)13-10(15)8(12)4-3-5-11/h7-9,14H,3-6,11-12H2,1-2H3,(H,13,15)/t8-,9+/m1/s1.
What are the key properties of (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
(2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide has a molecular weight of 217.31 g/mol, XLogP of -0.81, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,5-diamino-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pentanamide is sourced from PubChem (CID 57077113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).