(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide

C11H20N4O — CID 103914492

IUPAC(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide
SMILESCC(N[C@H](C)C(=O)N(C)C)c1nccn1C
InChIInChI=1S/C11H20N4O/c1-8(10-12-6-7-15(10)5)13-9(2)11(16)14(3)4/h6-9,13H,1-5H3/t8?,9-/m1/s1
InChIKeyZHPGYFWXDNTTTC-YGPZHTELSA-N
MW224.31 g/mol
LogP0.55
Rot. Bonds4

About (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide

(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide (PubChem CID 103914492) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide
PubChem CID103914492
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide
SMILESCC(N[C@H](C)C(=O)N(C)C)c1nccn1C
InChIInChI=1S/C11H20N4O/c1-8(10-12-6-7-15(10)5)13-9(2)11(16)14(3)4/h6-9,13H,1-5H3/t8?,9-/m1/s1
InChIKeyZHPGYFWXDNTTTC-YGPZHTELSA-N
XLogP0.55
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide?
The IUPAC name of (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide (CID 103914492) is (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide.
What is the SMILES notation for (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide?
The canonical SMILES for (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide is CC(N[C@H](C)C(=O)N(C)C)c1nccn1C.
What is the InChIKey of (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide?
The InChIKey is ZHPGYFWXDNTTTC-YGPZHTELSA-N. The full InChI is InChI=1S/C11H20N4O/c1-8(10-12-6-7-15(10)5)13-9(2)11(16)14(3)4/h6-9,13H,1-5H3/t8?,9-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide?
(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide has a molecular weight of 224.31 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide is sourced from PubChem (CID 103914492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).