[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine

C15H25N3 — CID 62298748

IUPAC[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine
SMILESCC(C)(C)C1CCN(c2ccnc(CN)c2)CC1
InChIInChI=1S/C15H25N3/c1-15(2,3)12-5-8-18(9-6-12)14-4-7-17-13(10-14)11-16/h4,7,10,12H,5-6,8-9,11,16H2,1-3H3
InChIKeyHWUAJAUFBQJGMJ-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.80
Rot. Bonds2

About [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine

[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine (PubChem CID 62298748) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine
PubChem CID62298748
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine
SMILESCC(C)(C)C1CCN(c2ccnc(CN)c2)CC1
InChIInChI=1S/C15H25N3/c1-15(2,3)12-5-8-18(9-6-12)14-4-7-17-13(10-14)11-16/h4,7,10,12H,5-6,8-9,11,16H2,1-3H3
InChIKeyHWUAJAUFBQJGMJ-UHFFFAOYSA-N
XLogP2.80
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]methanamine
CID 79182680
[4-(4,4-dimethylazepan-1-yl)-2-pyridinyl]methanamine
CID 65283213
1-[2-(aminomethyl)-4-pyridinyl]pyrrolidine-3,4-diol
CID 106667686
[3-(4-tert-butylazepan-1-yl)phenyl]methanamine
CID 102814062
4-(4-tert-butylpiperidin-1-yl)benzene-1,2-diamine
CID 106750697
[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine
CID 102955936
1-[4-(4-ethylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 62288899
[4-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-2-pyridinyl]methanamine
CID 114412650
2-methyl-N-[[4-(4-methylpiperazin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285764
N-[[4-(4-propan-2-ylpiperidin-1-yl)-2-pyridinyl]methyl]cyclopropanamine
CID 103503016
4-tert-butyl-1-phenylpiperidine
CID 612454
[4-(4-methoxypiperidin-1-yl)-2-pyridinyl]methanol
CID 61257075

Frequently Asked Questions

What is the IUPAC name of [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine (CID 62298748) is [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine is CC(C)(C)C1CCN(c2ccnc(CN)c2)CC1.
What is the InChIKey of [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine?
The InChIKey is HWUAJAUFBQJGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-15(2,3)12-5-8-18(9-6-12)14-4-7-17-13(10-14)11-16/h4,7,10,12H,5-6,8-9,11,16H2,1-3H3.
What are the key properties of [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine?
[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine has a molecular weight of 247.39 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 62298748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).