N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine

C16H28N4 — CID 102612303

IUPACN,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine
SMILESCc1nccnc1C(C)NCC1(N(C)C)CCCCC1
InChIInChI=1S/C16H28N4/c1-13-15(18-11-10-17-13)14(2)19-12-16(20(3)4)8-6-5-7-9-16/h10-11,14,19H,5-9,12H2,1-4H3
InChIKeyPWLMJYWWJFXXJG-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.70
Rot. Bonds5

About N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine

N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine (PubChem CID 102612303) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine
PubChem CID102612303
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine
SMILESCc1nccnc1C(C)NCC1(N(C)C)CCCCC1
InChIInChI=1S/C16H28N4/c1-13-15(18-11-10-17-13)14(2)19-12-16(20(3)4)8-6-5-7-9-16/h10-11,14,19H,5-9,12H2,1-4H3
InChIKeyPWLMJYWWJFXXJG-UHFFFAOYSA-N
XLogP2.70
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol
CID 102612705
[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol
CID 102612886
N,N-dimethyl-1-[[1-(4-methylphenyl)ethylamino]methyl]cyclopentan-1-amine
CID 81301036
N,N-dimethyl-1-[[1-(1,3-thiazol-4-yl)ethylamino]methyl]cyclopentan-1-amine
CID 113344938
N-(cyclobutylmethyl)-1-(3-methylpyrazin-2-yl)ethanamine
CID 102612552
N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
CID 114080351
1-[[1-(furan-2-yl)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 43201850
3-[1-(3-methylpyrazin-2-yl)ethylamino]-1-piperidin-1-ylpropan-1-one
CID 102612475
1-[[1-(5-fluoro-3-pyridinyl)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 103776011
1-[[1-(5-bromothiophen-2-yl)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 54898113
1-[[1-(2,5-dimethylthiophen-3-yl)ethylamino]methyl]-N,N-dimethylcyclopentan-1-amine
CID 81300272
1-[[1-(2,4-dimethylphenyl)ethylamino]methyl]-N,N-dimethylcyclopentan-1-amine
CID 83108539

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine (CID 102612303) is N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine is Cc1nccnc1C(C)NCC1(N(C)C)CCCCC1.
What is the InChIKey of N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine?
The InChIKey is PWLMJYWWJFXXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-13-15(18-11-10-17-13)14(2)19-12-16(20(3)4)8-6-5-7-9-16/h10-11,14,19H,5-9,12H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine?
N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine has a molecular weight of 276.43 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 102612303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).