N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide

C10H17N3O3 — CID 61235262

IUPACN,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide
SMILESO=C(CCn1ccnc1)N(CCO)CCO
InChIInChI=1S/C10H17N3O3/c14-7-5-13(6-8-15)10(16)1-3-12-4-2-11-9-12/h2,4,9,14-15H,1,3,5-8H2
InChIKeyZQZHRNCMBVWTOW-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.91
Rot. Bonds7

About N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide

N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide (PubChem CID 61235262) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide
PubChem CID61235262
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC NameN,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide
SMILESO=C(CCn1ccnc1)N(CCO)CCO
InChIInChI=1S/C10H17N3O3/c14-7-5-13(6-8-15)10(16)1-3-12-4-2-11-9-12/h2,4,9,14-15H,1,3,5-8H2
InChIKeyZQZHRNCMBVWTOW-UHFFFAOYSA-N
XLogP-0.91
TPSA78.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyethyl)-3-imidazol-1-yl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106613013
2-[ethyl(3-imidazol-1-ylpropanoyl)amino]acetic acid
CID 61021860
2-imidazol-1-ylethanol
CID 159023310
3-imidazol-1-ylpropanoyl chloride
CID 19872160
3-imidazol-1-ylpropanoic acid;hydrate
CID 174578472
3-[cyclopropyl(3-imidazol-1-ylpropanoyl)amino]propanoic acid
CID 60846258
3-imidazol-1-ylpropanamide;hydrate
CID 70092717
ethane;3-imidazol-1-ylpropanoic acid
CID 169203734
N,N-didecyl-10-[[10-(didecylamino)-10-oxodecyl]-(3-imidazol-1-ylpropyl)amino]decanamide
CID 168943789
3-[N-(3-imidazol-1-ylpropanoyl)anilino]propanoic acid
CID 60830430
ethyl 2-[3-imidazol-1-ylpropanoyl(prop-2-enyl)amino]acetate
CID 78954883
1-[3,5-bis(3-imidazol-1-ylpropanoyl)-1,3,5-triazinan-1-yl]-3-imidazol-1-ylpropan-1-one
CID 118048041

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide (CID 61235262) is N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide is O=C(CCn1ccnc1)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide?
The InChIKey is ZQZHRNCMBVWTOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c14-7-5-13(6-8-15)10(16)1-3-12-4-2-11-9-12/h2,4,9,14-15H,1,3,5-8H2.
What are the key properties of N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide?
N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide has a molecular weight of 227.26 g/mol, XLogP of -0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-3-imidazol-1-ylpropanamide is sourced from PubChem (CID 61235262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).