[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol

C14H19NO — CID 116997101

IUPAC[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol
SMILESCN1CCc2cc(CC3(CO)CC3)ccc21
InChIInChI=1S/C14H19NO/c1-15-7-4-12-8-11(2-3-13(12)15)9-14(10-16)5-6-14/h2-3,8,16H,4-7,9-10H2,1H3
InChIKeyPECYWYZZEINOMO-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.99
Rot. Bonds3

About [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol

[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol (PubChem CID 116997101) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol
PubChem CID116997101
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol
SMILESCN1CCc2cc(CC3(CO)CC3)ccc21
InChIInChI=1S/C14H19NO/c1-15-7-4-12-8-11(2-3-13(12)15)9-14(10-16)5-6-14/h2-3,8,16H,4-7,9-10H2,1H3
InChIKeyPECYWYZZEINOMO-UHFFFAOYSA-N
XLogP1.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-[(1-methyl-2,3-dihydroindol-5-yl)methyl]oxetan-3-yl]methanol
CID 116997114
N-[(1-ethylcyclopropyl)methyl]-1-(1-methyl-2,3-dihydroindol-5-yl)methanamine
CID 103838456
methyl 1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclobutane-1-carboxylate
CID 116997109
1-methyl-5-propyl-2,3-dihydroindole
CID 89046240
1-[2-(1-methyl-2,3-dihydroindol-5-yl)ethyl]cyclopropan-1-amine
CID 105470358
2-[(1-methyl-2,3-dihydroindol-5-yl)methylamino]propanoic acid
CID 62096350
N-methoxy-1-(1-methyl-2,3-dihydroindol-5-yl)methanamine
CID 82706033
3-(1-methyl-2,3-dihydroindol-5-yl)propan-1-amine
CID 62095510
1-amino-3-(1-methyl-2,3-dihydroindol-5-yl)propan-2-one
CID 82506730
2,2-dimethyl-3-[(1-methyl-2,3-dihydroindol-5-yl)methylamino]propan-1-ol
CID 115359011
2-methyl-3-[(1-methyl-2,3-dihydroindol-5-yl)methylamino]propan-1-ol
CID 65031805
2,2-dimethyl-3-(1-methyl-2,3-dihydroindol-5-yl)propanenitrile
CID 116997085

Frequently Asked Questions

What is the IUPAC name of [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol (CID 116997101) is [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol is CN1CCc2cc(CC3(CO)CC3)ccc21.
What is the InChIKey of [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol?
The InChIKey is PECYWYZZEINOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-15-7-4-12-8-11(2-3-13(12)15)9-14(10-16)5-6-14/h2-3,8,16H,4-7,9-10H2,1H3.
What are the key properties of [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol?
[1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol has a molecular weight of 217.31 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methyl-2,3-dihydroindol-5-yl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116997101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).