1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol

C8H16N2O — CID 131110917

IUPAC1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol
SMILESNCC(O)CN1CC2(CC2)C1
InChIInChI=1S/C8H16N2O/c9-3-7(11)4-10-5-8(6-10)1-2-8/h7,11H,1-6,9H2
InChIKeyUMQKPRHVPKXDQH-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.60
Rot. Bonds3

About 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol

1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol (PubChem CID 131110917) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol
PubChem CID131110917
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol
SMILESNCC(O)CN1CC2(CC2)C1
InChIInChI=1S/C8H16N2O/c9-3-7(11)4-10-5-8(6-10)1-2-8/h7,11H,1-6,9H2
InChIKeyUMQKPRHVPKXDQH-UHFFFAOYSA-N
XLogP-0.60
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 131048167
1-amino-3-(azonan-1-yl)propan-2-ol
CID 127001298
1-amino-3-(1,1-dioxo-1,4-thiazinan-4-yl)propan-2-ol
CID 20604768
1-amino-3-(3,3,4-trimethylpiperazin-1-yl)propan-2-ol
CID 63608754
(8S)-6-[(2S)-3-amino-2-hydroxypropyl]-6-azaspiro[2.5]octan-8-ol
CID 67080079
3-(5-azaspiro[2.3]hexan-5-yl)-2-methylpropan-1-ol
CID 104549778
1-amino-3-(4-propan-2-ylpiperidin-1-yl)propan-2-ol
CID 103494900
1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine
CID 79678743
2-(2-azaspiro[3.6]decan-2-yl)-1-cyclopropylethanol
CID 104549604
2-[4-(3-amino-2-hydroxypropyl)-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;gadolinium
CID 85360091
2-(2-methylpropyl)-2-azaspiro[3.3]heptane
CID 118300646

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol?
The IUPAC name of 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol (CID 131110917) is 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol.
What is the SMILES notation for 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol?
The canonical SMILES for 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol is NCC(O)CN1CC2(CC2)C1.
What is the InChIKey of 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol?
The InChIKey is UMQKPRHVPKXDQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c9-3-7(11)4-10-5-8(6-10)1-2-8/h7,11H,1-6,9H2.
What are the key properties of 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol?
1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol has a molecular weight of 156.23 g/mol, XLogP of -0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(5-azaspiro[2.3]hexan-5-yl)propan-2-ol is sourced from PubChem (CID 131110917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).