3-[(2R)-2-(aminomethyl)cyclopropyl]phenol

C10H13NO — CID 105432221

IUPAC3-[(2R)-2-(aminomethyl)cyclopropyl]phenol
SMILESNC[C@@H]1CC1c1cccc(O)c1
InChIInChI=1S/C10H13NO/c11-6-8-5-10(8)7-2-1-3-9(12)4-7/h1-4,8,10,12H,5-6,11H2/t8-,10?/m0/s1
InChIKeyNZTVPKOZOOULAP-PEHGTWAWSA-N
MW163.22 g/mol
LogP1.45
Rot. Bonds2

About 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol

3-[(2R)-2-(aminomethyl)cyclopropyl]phenol (PubChem CID 105432221) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol.

Molecular Properties

Compound Name3-[(2R)-2-(aminomethyl)cyclopropyl]phenol
PubChem CID105432221
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name3-[(2R)-2-(aminomethyl)cyclopropyl]phenol
SMILESNC[C@@H]1CC1c1cccc(O)c1
InChIInChI=1S/C10H13NO/c11-6-8-5-10(8)7-2-1-3-9(12)4-7/h1-4,8,10,12H,5-6,11H2/t8-,10?/m0/s1
InChIKeyNZTVPKOZOOULAP-PEHGTWAWSA-N
XLogP1.45
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[5-(aminomethyl)-2-methylpiperidin-4-yl]phenol
CID 82616502
[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride
CID 68924561
3-[4-(aminomethyl)piperidin-3-yl]phenol
CID 82610660
[2-(3-ethynylphenyl)cyclopropyl]methanamine
CID 75074269
[(1R,2S)-2-[3-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 94557656
[(1S,2R)-2-[3-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 94557654
3-[(1R,2R)-2-(aminomethyl)cyclopropyl]benzonitrile
CID 94556811
[2-(3-phenoxyphenyl)cyclopropyl]methanamine
CID 62708512
2-[[2-(3-hydroxyphenyl)cyclopropyl]methyl]butanamide
CID 174360497
3-[2-(aminomethyl)-1-methylpyrrolidin-3-yl]phenol
CID 105459318
(2-naphthalen-2-ylcyclopropyl)methanamine;hydrochloride
CID 68926193
3-[(1R,8S)-4-tricyclo[4.3.1.13,8]undecanyl]phenol
CID 132554060

Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol?
The IUPAC name of 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol (CID 105432221) is 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol.
What is the SMILES notation for 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol?
The canonical SMILES for 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol is NC[C@@H]1CC1c1cccc(O)c1.
What is the InChIKey of 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol?
The InChIKey is NZTVPKOZOOULAP-PEHGTWAWSA-N. The full InChI is InChI=1S/C10H13NO/c11-6-8-5-10(8)7-2-1-3-9(12)4-7/h1-4,8,10,12H,5-6,11H2/t8-,10?/m0/s1.
What are the key properties of 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol?
3-[(2R)-2-(aminomethyl)cyclopropyl]phenol has a molecular weight of 163.22 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-2-(aminomethyl)cyclopropyl]phenol is sourced from PubChem (CID 105432221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).