2-methylpropane;3-piperidin-1-ylpropan-1-amine

C12H28N2 — CID 161163740

IUPAC2-methylpropane;3-piperidin-1-ylpropan-1-amine
SMILESCC(C)C.NCCCN1CCCCC1
InChIInChI=1S/C8H18N2.C4H10/c9-5-4-8-10-6-2-1-3-7-10;1-4(2)3/h1-9H2;4H,1-3H3
InChIKeyUQGJBKRVJCGYKT-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.48
Rot. Bonds3

About 2-methylpropane;3-piperidin-1-ylpropan-1-amine

2-methylpropane;3-piperidin-1-ylpropan-1-amine (PubChem CID 161163740) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is 2-methylpropane;3-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name2-methylpropane;3-piperidin-1-ylpropan-1-amine
PubChem CID161163740
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC Name2-methylpropane;3-piperidin-1-ylpropan-1-amine
SMILESCC(C)C.NCCCN1CCCCC1
InChIInChI=1S/C8H18N2.C4H10/c9-5-4-8-10-6-2-1-3-7-10;1-4(2)3/h1-9H2;4H,1-3H3
InChIKeyUQGJBKRVJCGYKT-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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7-(azepan-1-yl)heptan-1-amine
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3-(4-butylpiperazin-1-yl)propan-1-amine;2-piperidin-1-ylethanamine
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3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amine;hydrochloride
CID 54610574
6-(azetidin-1-yl)hexan-1-amine
CID 18952651
N'-[6-(azepan-1-yl)hexyl]hexane-1,6-diamine;ethane
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3-(3-methylazecan-1-yl)propan-1-amine
CID 10680071
methane;2-piperidin-1-ylethanamine
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Frequently Asked Questions

What is the IUPAC name of 2-methylpropane;3-piperidin-1-ylpropan-1-amine?
The IUPAC name of 2-methylpropane;3-piperidin-1-ylpropan-1-amine (CID 161163740) is 2-methylpropane;3-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for 2-methylpropane;3-piperidin-1-ylpropan-1-amine?
The canonical SMILES for 2-methylpropane;3-piperidin-1-ylpropan-1-amine is CC(C)C.NCCCN1CCCCC1.
What is the InChIKey of 2-methylpropane;3-piperidin-1-ylpropan-1-amine?
The InChIKey is UQGJBKRVJCGYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.C4H10/c9-5-4-8-10-6-2-1-3-7-10;1-4(2)3/h1-9H2;4H,1-3H3.
What are the key properties of 2-methylpropane;3-piperidin-1-ylpropan-1-amine?
2-methylpropane;3-piperidin-1-ylpropan-1-amine has a molecular weight of 200.37 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropane;3-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 161163740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).