N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine

C14H23N5 — CID 74243230

IUPACN-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
SMILESCc1nccn1CCN(C)Cc1cncn1C(C)C
InChIInChI=1S/C14H23N5/c1-12(2)19-11-15-9-14(19)10-17(4)7-8-18-6-5-16-13(18)3/h5-6,9,11-12H,7-8,10H2,1-4H3
InChIKeyADVKQNQGKUNOSK-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.10
Rot. Bonds6

About N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine

N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine (PubChem CID 74243230) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
PubChem CID74243230
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
SMILESCc1nccn1CCN(C)Cc1cncn1C(C)C
InChIInChI=1S/C14H23N5/c1-12(2)19-11-15-9-14(19)10-17(4)7-8-18-6-5-16-13(18)3/h5-6,9,11-12H,7-8,10H2,1-4H3
InChIKeyADVKQNQGKUNOSK-UHFFFAOYSA-N
XLogP2.10
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methoxypyrimidin-5-yl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
CID 131900895
1-N-methyl-1-N-[2-(2-methylimidazol-1-yl)ethyl]propane-1,2-diamine
CID 63759365
2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]acetic acid
CID 61493400
3,5-dimethyl-2-[[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]methyl]-1H-pyridin-4-one
CID 91829123
1-methoxy-3-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]propan-2-ol
CID 62016741
2-chloro-3-methoxy-N-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
CID 63387621
2-methyl-4-[4-[[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]methyl]phenyl]butan-2-ol
CID 70753429
5-ethyl-N,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]pyrimidin-4-amine
CID 50965256
N-[[3-(3-chlorophenyl)-1-methylpyrazol-4-yl]methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
CID 42529841
2-methyl-5-[[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 135118923
N-methyl-2-(2-methylimidazol-1-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamine
CID 74238312
2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]-N-(1-methylpyrazol-3-yl)acetamide
CID 91834462

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The IUPAC name of N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine (CID 74243230) is N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine.
What is the SMILES notation for N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The canonical SMILES for N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine is Cc1nccn1CCN(C)Cc1cncn1C(C)C.
What is the InChIKey of N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The InChIKey is ADVKQNQGKUNOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-12(2)19-11-15-9-14(19)10-17(4)7-8-18-6-5-16-13(18)3/h5-6,9,11-12H,7-8,10H2,1-4H3.
What are the key properties of N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine has a molecular weight of 261.37 g/mol, XLogP of 2.10, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylimidazol-1-yl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine is sourced from PubChem (CID 74243230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).