1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine

C16H21N3 — CID 74247420

IUPAC1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine
SMILESCN(Cc1cnc2ccccn12)CC1CC=CCC1
InChIInChI=1S/C16H21N3/c1-18(12-14-7-3-2-4-8-14)13-15-11-17-16-9-5-6-10-19(15)16/h2-3,5-6,9-11,14H,4,7-8,12-13H2,1H3
InChIKeyNADWVSADDRRVBD-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.12
Rot. Bonds4

About 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine

1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine (PubChem CID 74247420) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine
PubChem CID74247420
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine
SMILESCN(Cc1cnc2ccccn12)CC1CC=CCC1
InChIInChI=1S/C16H21N3/c1-18(12-14-7-3-2-4-8-14)13-15-11-17-16-9-5-6-10-19(15)16/h2-3,5-6,9-11,14H,4,7-8,12-13H2,1H3
InChIKeyNADWVSADDRRVBD-UHFFFAOYSA-N
XLogP3.12
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine?
The IUPAC name of 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine (CID 74247420) is 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine is CN(Cc1cnc2ccccn12)CC1CC=CCC1.
What is the InChIKey of 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine?
The InChIKey is NADWVSADDRRVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-18(12-14-7-3-2-4-8-14)13-15-11-17-16-9-5-6-10-19(15)16/h2-3,5-6,9-11,14H,4,7-8,12-13H2,1H3.
What are the key properties of 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine?
1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine has a molecular weight of 255.37 g/mol, XLogP of 3.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine is sourced from PubChem (CID 74247420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).