(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol

C6H11NO — CID 154406268

IUPAC(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol
SMILESCC1=CNC(CO)C1
InChIInChI=1S/C6H11NO/c1-5-2-6(4-8)7-3-5/h3,6-8H,2,4H2,1H3
InChIKeyFZWQGZDXQUCCFS-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.24
Rot. Bonds1

About (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol

(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol (PubChem CID 154406268) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol.

Molecular Properties

Compound Name(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol
PubChem CID154406268
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol
SMILESCC1=CNC(CO)C1
InChIInChI=1S/C6H11NO/c1-5-2-6(4-8)7-3-5/h3,6-8H,2,4H2,1H3
InChIKeyFZWQGZDXQUCCFS-UHFFFAOYSA-N
XLogP0.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Methylamino)-3-methylidenepentan-1-ol
CID 59110297
[(2S)-5-ethyl-1,2,3,4-tetrahydropyridin-2-yl]methanol
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(E,2S)-2-amino-5-(ethenylamino)-4-methylpent-4-en-1-ol
CID 89028837
(E)-2-amino-5-(ethenylamino)-4-methylpent-4-en-1-ol
CID 89112503
2-(Methylamino)hex-5-en-1-ol
CID 89937108
1,2,3,4-Tetrahydropyridin-2-ylmethanol
CID 90421063
[(2S)-4,5-dimethyl-2,3-dihydro-1H-pyrrol-2-yl]methanol
CID 91105522
[(2S)-4-methyl-2,3-dihydro-1H-pyrrol-2-yl]methanol
CID 141417336
Ethane;4-methyl-2-(methylamino)pent-4-en-1-ol
CID 142030684
2-(hydroxymethyl)-4-methyl-2,3-dihydro-1H-pyrrol-5-ol
CID 156837370
2-(Hydroxymethyl)-4-methyl-1,2-dihydropyrrole-3,3-diol
CID 156837471
(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol
CID 55254052

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol?
The IUPAC name of (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol (CID 154406268) is (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol.
What is the SMILES notation for (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol?
The canonical SMILES for (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol is CC1=CNC(CO)C1.
What is the InChIKey of (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol?
The InChIKey is FZWQGZDXQUCCFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-5-2-6(4-8)7-3-5/h3,6-8H,2,4H2,1H3.
What are the key properties of (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol?
(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol has a molecular weight of 113.16 g/mol, XLogP of 0.24, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methanol is sourced from PubChem (CID 154406268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).