N-(pyridin-2-ylmethyl)but-1-en-2-amine

C10H14N2 — CID 129060114

IUPACN-(pyridin-2-ylmethyl)but-1-en-2-amine
SMILESC=C(CC)NCc1ccccn1
InChIInChI=1S/C10H14N2/c1-3-9(2)12-8-10-6-4-5-7-11-10/h4-7,12H,2-3,8H2,1H3
InChIKeyTXNPYYIVQLTZEO-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.09
Rot. Bonds4

About N-(pyridin-2-ylmethyl)but-1-en-2-amine

N-(pyridin-2-ylmethyl)but-1-en-2-amine (PubChem CID 129060114) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)but-1-en-2-amine.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)but-1-en-2-amine
PubChem CID129060114
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-(pyridin-2-ylmethyl)but-1-en-2-amine
SMILESC=C(CC)NCc1ccccn1
InChIInChI=1S/C10H14N2/c1-3-9(2)12-8-10-6-4-5-7-11-10/h4-7,12H,2-3,8H2,1H3
InChIKeyTXNPYYIVQLTZEO-UHFFFAOYSA-N
XLogP2.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(pyridin-2-ylmethyl)prop-2-enamide
CID 142012577
1-(4-ethylphenyl)-N-(pyridin-2-ylmethyl)ethenamine
CID 142929001
N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide
CID 47412168
1-prop-1-en-2-yl-3-(pyridin-2-ylmethyl)urea
CID 108910258
2-(hydroxyamino)-N-(pyridin-2-ylmethyl)prop-2-enamide
CID 3676320
2-ethyl-N-(pyridin-2-ylmethyl)butanamide
CID 5055685
pyridin-2-ylmethylcarbamothioic S-acid
CID 22756402
2,2-dimethyl-N,N'-bis(pyridin-2-ylmethyl)propanediamide
CID 108963334
N,N-diethylethanamine;pyridin-2-ylmethylcarbamothioic S-acid
CID 173452330
N',N'-diethyl-N-(pyridin-2-ylmethyl)oxamide
CID 108518344
2-ethylsulfanyl-N-(pyridin-2-ylmethyl)acetamide
CID 19005858
4-methylidene-1-pyridin-2-ylhexan-2-one
CID 66045043

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)but-1-en-2-amine?
The IUPAC name of N-(pyridin-2-ylmethyl)but-1-en-2-amine (CID 129060114) is N-(pyridin-2-ylmethyl)but-1-en-2-amine.
What is the SMILES notation for N-(pyridin-2-ylmethyl)but-1-en-2-amine?
The canonical SMILES for N-(pyridin-2-ylmethyl)but-1-en-2-amine is C=C(CC)NCc1ccccn1.
What is the InChIKey of N-(pyridin-2-ylmethyl)but-1-en-2-amine?
The InChIKey is TXNPYYIVQLTZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-9(2)12-8-10-6-4-5-7-11-10/h4-7,12H,2-3,8H2,1H3.
What are the key properties of N-(pyridin-2-ylmethyl)but-1-en-2-amine?
N-(pyridin-2-ylmethyl)but-1-en-2-amine has a molecular weight of 162.24 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)but-1-en-2-amine is sourced from PubChem (CID 129060114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).