2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine

C14H23N3 — CID 81004724

IUPAC2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
SMILESCCN(Cc1cccc(C)n1)C1CCC1CN
InChIInChI=1S/C14H23N3/c1-3-17(14-8-7-12(14)9-15)10-13-6-4-5-11(2)16-13/h4-6,12,14H,3,7-10,15H2,1-2H3
InChIKeyCPVYLNXIUSSSQK-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.95
Rot. Bonds5

About 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine

2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine (PubChem CID 81004724) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
PubChem CID81004724
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
SMILESCCN(Cc1cccc(C)n1)C1CCC1CN
InChIInChI=1S/C14H23N3/c1-3-17(14-8-7-12(14)9-15)10-13-6-4-5-11(2)16-13/h4-6,12,14H,3,7-10,15H2,1-2H3
InChIKeyCPVYLNXIUSSSQK-UHFFFAOYSA-N
XLogP1.95
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(methylaminomethyl)-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
CID 81004723
N-ethyl-2-[(2-methylpropylamino)methyl]-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
CID 81000122
N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]-4-methylsulfanylpyrrolidin-3-amine
CID 82760340
2-N-ethyl-2-N-[(6-methyl-2-pyridinyl)methyl]-1-N-(2-methylquinolin-8-yl)cyclohexane-1,2-diamine
CID 176649647
N-(2-chloroethyl)-N-[(6-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 79260720
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 81004725
3-[cyclopropyl-[(6-methyl-2-pyridinyl)methyl]amino]propanethioamide
CID 79266921
[2-[(6-methyl-2-pyridinyl)methoxy]cyclopentyl]methanamine
CID 79260946
3-[cyclobutyl-[(6-methyl-2-pyridinyl)methyl]amino]propan-1-ol
CID 102848805
3-amino-2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]propan-1-ol
CID 104711102
2-N,2-diethyl-2-N-[(6-methyl-2-pyridinyl)methyl]butane-1,2-diamine
CID 79267944
3-[cyclopropyl-[(6-methyl-2-pyridinyl)methyl]amino]propanoic acid
CID 79260864

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine (CID 81004724) is 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine is CCN(Cc1cccc(C)n1)C1CCC1CN.
What is the InChIKey of 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine?
The InChIKey is CPVYLNXIUSSSQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-17(14-8-7-12(14)9-15)10-13-6-4-5-11(2)16-13/h4-6,12,14H,3,7-10,15H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine?
2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 81004724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).