N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide

C10H17N3O2 — CID 103919885

IUPACN-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide
SMILESCC[C@H](CO)NC(=O)CCn1ccnc1
InChIInChI=1S/C10H17N3O2/c1-2-9(7-14)12-10(15)3-5-13-6-4-11-8-13/h4,6,8-9,14H,2-3,5,7H2,1H3,(H,12,15)/t9-/m1/s1
InChIKeyVLUYPRZQUDIVKT-SECBINFHSA-N
MW211.26 g/mol
LogP0.16
Rot. Bonds6

About N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide

N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide (PubChem CID 103919885) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide
PubChem CID103919885
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide
SMILESCC[C@H](CO)NC(=O)CCn1ccnc1
InChIInChI=1S/C10H17N3O2/c1-2-9(7-14)12-10(15)3-5-13-6-4-11-8-13/h4,6,8-9,14H,2-3,5,7H2,1H3,(H,12,15)/t9-/m1/s1
InChIKeyVLUYPRZQUDIVKT-SECBINFHSA-N
XLogP0.16
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-imidazol-1-ylpropanamide
CID 102673648
N-(4-hydroxybutan-2-yl)-3-imidazol-1-ylpropanamide
CID 115283469
3-hydroxy-2-(3-imidazol-1-ylpropanoylamino)propanoic acid
CID 24702639
(2S)-2-(3-imidazol-1-ylpropanoylamino)pentanoic acid
CID 107564539
N-[(2R)-1-hydroxybutan-2-yl]-3-(triazol-1-yl)propanamide
CID 103920188
2-bromo-N-(1-imidazol-1-ylbutan-2-yl)acetamide
CID 82110009
N-(1-hydroxybutan-2-yl)-3-(4-nitroimidazol-1-yl)propanamide
CID 43417891
N-(2-aminopropyl)-3-imidazol-1-ylpropanamide
CID 63733352
N-butan-2-yl-3-(3-imidazol-1-ylpropylamino)propanamide
CID 54961391
ethane;3-imidazol-1-ylpropanoic acid
CID 169203734
3-imidazol-1-yl-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]propanamide
CID 126446389
N-(2,3-dihydroxy-2-methylpropyl)-3-imidazol-1-ylpropanamide
CID 66171307

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide?
The IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide (CID 103919885) is N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide.
What is the SMILES notation for N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide?
The canonical SMILES for N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide is CC[C@H](CO)NC(=O)CCn1ccnc1.
What is the InChIKey of N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide?
The InChIKey is VLUYPRZQUDIVKT-SECBINFHSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-9(7-14)12-10(15)3-5-13-6-4-11-8-13/h4,6,8-9,14H,2-3,5,7H2,1H3,(H,12,15)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide?
N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide has a molecular weight of 211.26 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxybutan-2-yl]-3-imidazol-1-ylpropanamide is sourced from PubChem (CID 103919885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).