6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine

C15H21N3 — CID 62284712

IUPAC6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine
SMILESC=CCN(CC=C)c1cccc(CNC2CC2)n1
InChIInChI=1S/C15H21N3/c1-3-10-18(11-4-2)15-7-5-6-14(17-15)12-16-13-8-9-13/h3-7,13,16H,1-2,8-12H2
InChIKeyKKFCEMFZRGDOAB-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.51
Rot. Bonds8

About 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine

6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine (PubChem CID 62284712) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine.

Molecular Properties

Compound Name6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine
PubChem CID62284712
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine
SMILESC=CCN(CC=C)c1cccc(CNC2CC2)n1
InChIInChI=1S/C15H21N3/c1-3-10-18(11-4-2)15-7-5-6-14(17-15)12-16-13-8-9-13/h3-7,13,16H,1-2,8-12H2
InChIKeyKKFCEMFZRGDOAB-UHFFFAOYSA-N
XLogP2.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-(aminomethyl)-N,N-bis(prop-2-enyl)pyridin-2-amine
CID 62299091
6-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62292802
6-[(cyclopropylamino)methyl]-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 62281585
6-[(cyclopropylamino)methyl]-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62284157
6-[(cyclopropylamino)methyl]-N-(2-fluorophenyl)-N-methylpyridin-2-amine
CID 62294639
2-N-[6-[(cyclopropylamino)methyl]-2-pyridinyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191474
6-[(cyclopropylamino)methyl]-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
CID 62295485
6-[(cyclopropylamino)methyl]-N-(furan-2-ylmethyl)-N-methylpyridin-2-amine
CID 62280784
6-[(cyclopropylamino)methyl]-N-(2,4-dimethylphenyl)-N-methylpyridin-2-amine
CID 62293980
N-[(3-bromophenyl)methyl]-6-[(cyclopropylamino)methyl]-N-methylpyridin-2-amine
CID 62293133
3-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-4-amine
CID 81250020
6-[(cyclopropylamino)methyl]-N-methyl-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 62281474

Frequently Asked Questions

What is the IUPAC name of 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine?
The IUPAC name of 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine (CID 62284712) is 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine.
What is the SMILES notation for 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine?
The canonical SMILES for 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine is C=CCN(CC=C)c1cccc(CNC2CC2)n1.
What is the InChIKey of 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine?
The InChIKey is KKFCEMFZRGDOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-3-10-18(11-4-2)15-7-5-6-14(17-15)12-16-13-8-9-13/h3-7,13,16H,1-2,8-12H2.
What are the key properties of 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine?
6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine has a molecular weight of 243.35 g/mol, XLogP of 2.51, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-2-amine is sourced from PubChem (CID 62284712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).