2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine

C11H22N2 — CID 79678047

IUPAC2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine
SMILESCC(C)CC(CN)N1CC2(CC2)C1
InChIInChI=1S/C11H22N2/c1-9(2)5-10(6-12)13-7-11(8-13)3-4-11/h9-10H,3-8,12H2,1-2H3
InChIKeyHHCQEOVBSGSGGY-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.46
Rot. Bonds4

About 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine

2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine (PubChem CID 79678047) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine.

Molecular Properties

Compound Name2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine
PubChem CID79678047
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine
SMILESCC(C)CC(CN)N1CC2(CC2)C1
InChIInChI=1S/C11H22N2/c1-9(2)5-10(6-12)13-7-11(8-13)3-4-11/h9-10H,3-8,12H2,1-2H3
InChIKeyHHCQEOVBSGSGGY-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4,4-diethylpiperidin-1-yl)-4-methylpentan-1-amine
CID 63156923
4-methyl-2-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 43585175
2-(2,2-dimethylmorpholin-4-yl)-4-methylpentan-1-amine
CID 43592633
4-(5-azaspiro[2.3]hexan-5-yl)pentan-2-amine
CID 130646251
2-(4-butan-2-ylpiperazin-1-yl)-4-methylpentan-1-amine
CID 55117502
4-methyl-2-(4-methylpiperidin-1-yl)pentan-1-amine
CID 16783937
4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-1-amine
CID 66391877
1-(1-amino-4-methylpentan-2-yl)-N,N-dimethylpiperidin-4-amine
CID 43585844
2-(5-azaspiro[2.3]hexan-5-yl)-3-methoxypropan-1-ol
CID 106187086
1-(1-amino-4-methylpentan-2-yl)-N,N-dimethylpyrrolidin-3-amine
CID 63166510
3-(7-oxa-2-azaspiro[3.5]nonan-2-yl)pentan-1-amine
CID 79687539
1-amino-3-(5-azaspiro[2.4]heptan-5-yl)butan-2-ol
CID 164657577

Frequently Asked Questions

What is the IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine?
The IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine (CID 79678047) is 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine.
What is the SMILES notation for 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine?
The canonical SMILES for 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine is CC(C)CC(CN)N1CC2(CC2)C1.
What is the InChIKey of 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine?
The InChIKey is HHCQEOVBSGSGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(2)5-10(6-12)13-7-11(8-13)3-4-11/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine?
2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-azaspiro[2.3]hexan-5-yl)-4-methylpentan-1-amine is sourced from PubChem (CID 79678047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).