N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine

C17H29N3 — CID 115939191

IUPACN-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)C2CCCCC2)cn1
InChIInChI=1S/C17H29N3/c1-4-16(18-5-2)17-12-11-15(13-19-17)20(3)14-9-7-6-8-10-14/h11-14,16,18H,4-10H2,1-3H3
InChIKeySPIULIOOOUIDBB-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.91
Rot. Bonds6

About N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine

N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine (PubChem CID 115939191) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
PubChem CID115939191
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)C2CCCCC2)cn1
InChIInChI=1S/C17H29N3/c1-4-16(18-5-2)17-12-11-15(13-19-17)20(3)14-9-7-6-8-10-14/h11-14,16,18H,4-10H2,1-3H3
InChIKeySPIULIOOOUIDBB-UHFFFAOYSA-N
XLogP3.91
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The IUPAC name of N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine (CID 115939191) is N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine.
What is the SMILES notation for N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The canonical SMILES for N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine is CCNC(CC)c1ccc(N(C)C2CCCCC2)cn1.
What is the InChIKey of N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The InChIKey is SPIULIOOOUIDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-16(18-5-2)17-12-11-15(13-19-17)20(3)14-9-7-6-8-10-14/h11-14,16,18H,4-10H2,1-3H3.
What are the key properties of N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine has a molecular weight of 275.44 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine is sourced from PubChem (CID 115939191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).