[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol

C15H23NO — CID 115243342

IUPAC[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol
SMILESCc1cc(C)c(N(C)CC2(CO)CC2)c(C)c1
InChIInChI=1S/C15H23NO/c1-11-7-12(2)14(13(3)8-11)16(4)9-15(10-17)5-6-15/h7-8,17H,5-6,9-10H2,1-4H3
InChIKeyHVOQQRXHAZRYNY-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.82
Rot. Bonds4

About [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol

[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol (PubChem CID 115243342) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol
PubChem CID115243342
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol
SMILESCc1cc(C)c(N(C)CC2(CO)CC2)c(C)c1
InChIInChI=1S/C15H23NO/c1-11-7-12(2)14(13(3)8-11)16(4)9-15(10-17)5-6-15/h7-8,17H,5-6,9-10H2,1-4H3
InChIKeyHVOQQRXHAZRYNY-UHFFFAOYSA-N
XLogP2.82
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(4-methoxy-N,2,5-trimethylanilino)methyl]cyclopropyl]methanol
CID 115243345
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methoxy-N,4,6-trimethylaniline
CID 115244018
[1-[(N,2-dimethyl-5-propan-2-ylanilino)methyl]cyclopropyl]methanol
CID 115243384
[3-[(2-methoxy-N,3,5-trimethylanilino)methyl]oxetan-3-yl]methanol
CID 115248903
[1-[(2,4-dichloro-N-methylanilino)methyl]cyclopropyl]methanol
CID 115243413
[1-[[(3,4-dimethylphenyl)methyl-methylamino]methyl]cyclopropyl]methanol
CID 115243516
[1-[(5-bromo-2-fluoro-N-methylanilino)methyl]cyclopropyl]methanol
CID 115243408
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methoxy-N,3,5-trimethylaniline
CID 115243996
[4-[(2,4,6-trimethylphenyl)methyl]piperidin-4-yl]methanol
CID 66024977
3-(N,2,4,6-tetramethylanilino)propane-1,2-diol
CID 115121983
[1-[(4-ethoxy-N,3-dimethylanilino)methyl]cyclobutyl]methanol
CID 115246834
[1-[(4-ethoxy-N-methylanilino)methyl]cyclopropyl]methanol
CID 115243346

Frequently Asked Questions

What is the IUPAC name of [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol (CID 115243342) is [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol is Cc1cc(C)c(N(C)CC2(CO)CC2)c(C)c1.
What is the InChIKey of [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol?
The InChIKey is HVOQQRXHAZRYNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-7-12(2)14(13(3)8-11)16(4)9-15(10-17)5-6-15/h7-8,17H,5-6,9-10H2,1-4H3.
What are the key properties of [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol?
[1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol has a molecular weight of 233.35 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(N,2,4,6-tetramethylanilino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 115243342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).