[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine

C16H25N3 — CID 81247840

IUPAC[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine
SMILESCc1cc(N2CCC3(CCCC3)CC2)c(CN)cn1
InChIInChI=1S/C16H25N3/c1-13-10-15(14(11-17)12-18-13)19-8-6-16(7-9-19)4-2-3-5-16/h10,12H,2-9,11,17H2,1H3
InChIKeyKXBJAHGUCMMSER-UHFFFAOYSA-N
MW259.40 g/mol
LogP3.01
Rot. Bonds2

About [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine

[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine (PubChem CID 81247840) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine
PubChem CID81247840
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine
SMILESCc1cc(N2CCC3(CCCC3)CC2)c(CN)cn1
InChIInChI=1S/C16H25N3/c1-13-10-15(14(11-17)12-18-13)19-8-6-16(7-9-19)4-2-3-5-16/h10,12H,2-9,11,17H2,1H3
InChIKeyKXBJAHGUCMMSER-UHFFFAOYSA-N
XLogP3.01
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3,3-diethylpyrrolidin-1-yl)-6-methyl-3-pyridinyl]methanamine
CID 81247679
[6-methyl-4-(1,4-oxazepan-4-yl)-3-pyridinyl]methanamine
CID 81248036
[4-(3,4-dimethylpyrrolidin-1-yl)-6-methyl-3-pyridinyl]methanamine
CID 81248079
[6-methyl-4-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-3-pyridinyl]methanamine
CID 114412721
[6-methyl-4-(3-piperidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81247429
[4-(4-ethyl-4-methylpiperidin-1-yl)-6-methyl-3-pyridinyl]methanol
CID 81238758
[4-(8-azaspiro[4.5]decan-8-yl)-2,3-difluorophenyl]methanamine
CID 107932929
1-[4-(4-ethyl-4-methylpiperidin-1-yl)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 81248041
N-[[4-(4,4-dimethylazepan-1-yl)-6-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 81254147
[4-(3,3-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methanol
CID 81238075
1-[5-(chloromethyl)-2-methyl-4-pyridinyl]-4-methylpiperazine
CID 81238657
4-(8-azaspiro[4.5]decan-8-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 81037183

Frequently Asked Questions

What is the IUPAC name of [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine?
The IUPAC name of [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine (CID 81247840) is [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine is Cc1cc(N2CCC3(CCCC3)CC2)c(CN)cn1.
What is the InChIKey of [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine?
The InChIKey is KXBJAHGUCMMSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-13-10-15(14(11-17)12-18-13)19-8-6-16(7-9-19)4-2-3-5-16/h10,12H,2-9,11,17H2,1H3.
What are the key properties of [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine?
[4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine has a molecular weight of 259.40 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(8-azaspiro[4.5]decan-8-yl)-6-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 81247840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).