(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol

C8H17NO — CID 55285887

IUPAC(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol
SMILESCC1(C)CCC[C@@]1(O)CN
InChIInChI=1S/C8H17NO/c1-7(2)4-3-5-8(7,10)6-9/h10H,3-6,9H2,1-2H3/t8-/m1/s1
InChIKeyYIFCNTAAVCXKBG-MRVPVSSYSA-N
MW143.23 g/mol
LogP0.89
Rot. Bonds1

About (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol

(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol (PubChem CID 55285887) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol
PubChem CID55285887
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol
SMILESCC1(C)CCC[C@@]1(O)CN
InChIInChI=1S/C8H17NO/c1-7(2)4-3-5-8(7,10)6-9/h10H,3-6,9H2,1-2H3/t8-/m1/s1
InChIKeyYIFCNTAAVCXKBG-MRVPVSSYSA-N
XLogP0.89
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol (CID 55285887) is (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol is CC1(C)CCC[C@@]1(O)CN.
What is the InChIKey of (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol?
The InChIKey is YIFCNTAAVCXKBG-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)4-3-5-8(7,10)6-9/h10H,3-6,9H2,1-2H3/t8-/m1/s1.
What are the key properties of (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol?
(1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(aminomethyl)-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 55285887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).