ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine

C12H21N3 — CID 164882777

IUPACethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
SMILESCC.Cc1ccc(N2CCC(N)C2)cn1
InChIInChI=1S/C10H15N3.C2H6/c1-8-2-3-10(6-12-8)13-5-4-9(11)7-13;1-2/h2-3,6,9H,4-5,7,11H2,1H3;1-2H3
InChIKeySEZCBKBAUQWOPU-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.95
Rot. Bonds1

About ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine

ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine (PubChem CID 164882777) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine.

Molecular Properties

Compound Nameethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
PubChem CID164882777
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Nameethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
SMILESCC.Cc1ccc(N2CCC(N)C2)cn1
InChIInChI=1S/C10H15N3.C2H6/c1-8-2-3-10(6-12-8)13-5-4-9(11)7-13;1-2/h2-3,6,9H,4-5,7,11H2,1H3;1-2H3
InChIKeySEZCBKBAUQWOPU-UHFFFAOYSA-N
XLogP1.95
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-fluoro-3-pyridinyl)pyrrolidin-3-amine
CID 66854552
4-fluoro-1-(6-methyl-3-pyridinyl)piperidin-3-ol
CID 172576145
(3R)-1-(4-methylphenyl)pyrrolidin-3-amine
CID 93285995
5-(3-fluoropiperidin-1-yl)-2-methylpyridine
CID 156752811
(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 163295914
(3R)-1-(6-chloro-5-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 131173225
ethane;1-[1-(6-methyl-3-pyridinyl)piperidin-4-yl]ethanol
CID 156652004
1-(2,5-dimethyl-4-pyridinyl)pyrrolidin-3-amine
CID 83829915
2-methyl-5-(4-methylsulfanylpiperidin-1-yl)pyridine
CID 123718410
(1R,6S)-3-(6-methyl-3-pyridinyl)-3,8-diazabicyclo[4.2.0]octane
CID 66757628
5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine
CID 164927032
1-(4-tert-butylphenyl)pyrrolidin-3-amine
CID 43314959

Frequently Asked Questions

What is the IUPAC name of ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The IUPAC name of ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine (CID 164882777) is ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine.
What is the SMILES notation for ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The canonical SMILES for ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine is CC.Cc1ccc(N2CCC(N)C2)cn1.
What is the InChIKey of ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The InChIKey is SEZCBKBAUQWOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3.C2H6/c1-8-2-3-10(6-12-8)13-5-4-9(11)7-13;1-2/h2-3,6,9H,4-5,7,11H2,1H3;1-2H3.
What are the key properties of ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine has a molecular weight of 207.32 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine is sourced from PubChem (CID 164882777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).