N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine

C15H25N5 — CID 167929138

IUPACN-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
SMILESCc1nc(CNC(c2cnn(C)c2)C(C)(C)C)c(C)[nH]1
InChIInChI=1S/C15H25N5/c1-10-13(19-11(2)18-10)8-16-14(15(3,4)5)12-7-17-20(6)9-12/h7,9,14,16H,8H2,1-6H3,(H,18,19)
InChIKeyGYELMYKPIGLEET-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.64
Rot. Bonds4

About N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine

N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine (PubChem CID 167929138) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine.

Molecular Properties

Compound NameN-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
PubChem CID167929138
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
SMILESCc1nc(CNC(c2cnn(C)c2)C(C)(C)C)c(C)[nH]1
InChIInChI=1S/C15H25N5/c1-10-13(19-11(2)18-10)8-16-14(15(3,4)5)12-7-17-20(6)9-12/h7,9,14,16H,8H2,1-6H3,(H,18,19)
InChIKeyGYELMYKPIGLEET-UHFFFAOYSA-N
XLogP2.64
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
CID 43492399
2,2-dimethyl-1-(1-methylpyrazol-4-yl)-N-propylpropan-1-amine
CID 43497251
N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)butan-1-amine
CID 115808764
N-[2,2,2-trifluoro-1-(1-methylpyrazol-4-yl)ethyl]propan-1-amine
CID 43497243
(3R,4S)-N-[2,2-dimethyl-1-(1-methylpyrazol-4-yl)propyl]-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide
CID 120937117
2-(azepan-1-yl)-N-ethyl-2-methyl-1-(1-methylpyrazol-4-yl)propan-1-amine
CID 79051106
4-[[(1R)-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propyl]carbamoyl]benzoic acid
CID 129466846
5-[[2,2-dimethyl-1-(1-methylpyrazol-4-yl)propyl]carbamoyl]thiophene-2-carboxylic acid
CID 119187279
2-methyl-N-[[5-(1-methylpyrazol-4-yl)-1H-imidazol-2-yl]methyl]propan-2-amine
CID 63926372
N,N-diethyl-1-hydrazinyl-2-methyl-1-(1-methylpyrazol-4-yl)propan-2-amine
CID 105239216
N-[2,2-dimethyl-1-(1-methylpyrazol-4-yl)propyl]-2-oxo-6-propan-2-yl-1H-pyridine-3-carboxamide
CID 138026433
2-[[2,2-dimethyl-1-(1-methylpyrazol-4-yl)propyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 119187280

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The IUPAC name of N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine (CID 167929138) is N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine.
What is the SMILES notation for N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The canonical SMILES for N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine is Cc1nc(CNC(c2cnn(C)c2)C(C)(C)C)c(C)[nH]1.
What is the InChIKey of N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The InChIKey is GYELMYKPIGLEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10-13(19-11(2)18-10)8-16-14(15(3,4)5)12-7-17-20(6)9-12/h7,9,14,16H,8H2,1-6H3,(H,18,19).
What are the key properties of N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine has a molecular weight of 275.40 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine is sourced from PubChem (CID 167929138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).