(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine

C10H13NO — CID 163415695

IUPAC(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine
SMILESC=C1C=C2CCOC(CN)C2=C1
InChIInChI=1S/C10H13NO/c1-7-4-8-2-3-12-10(6-11)9(8)5-7/h4-5,10H,1-3,6,11H2
InChIKeyAEEUBRMIICMQTC-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.16
Rot. Bonds1

About (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine

(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine (PubChem CID 163415695) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine.

Molecular Properties

Compound Name(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine
PubChem CID163415695
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine
SMILESC=C1C=C2CCOC(CN)C2=C1
InChIInChI=1S/C10H13NO/c1-7-4-8-2-3-12-10(6-11)9(8)5-7/h4-5,10H,1-3,6,11H2
InChIKeyAEEUBRMIICMQTC-UHFFFAOYSA-N
XLogP1.16
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3a,6-dihydro-2H-cyclopenta[e][1]benzofuran-8-yl)ethanamine;hydrochloride
CID 22004817
2-(3a,6-dihydro-2H-cyclopenta[e][1]benzofuran-8-yl)ethanamine
CID 22004818
2-(2,3,4,5-Tetrahydro-1-benzofuran-2-yl)ethanamine
CID 57288704
3,5-dihydro-2H-1-benzofuran-5-id-2-ylmethanamine;yttrium
CID 59106161
3-(1,3-Dihydrocyclopenta[c]pyran-4-yl)propan-1-amine
CID 67558971
1-(5,7-dimethyl-1,3,4,6-tetrahydrocyclopenta[c]pyran-1-yl)-N-methylmethanamine
CID 89532756
1,3,4,6-Tetrahydrocyclopenta[c]pyran-1-ylmethanamine
CID 89532757
(5,7-Dimethyl-1,3,4,6-tetrahydrocyclopenta[c]pyran-1-yl)methanamine
CID 89532758
N-methyl-1-(1,3,4,6-tetrahydrocyclopenta[c]pyran-1-yl)methanamine
CID 89532761
[(4Z)-4-hexan-2-ylidene-3-propan-2-ylideneoxan-2-yl]methanamine
CID 129015888
[(3E,4Z)-3-ethylidene-4-pentylideneoxan-2-yl]methanamine
CID 129015898
2,3,4,5-Tetrahydro-1-benzofuran-3-amine
CID 129116475

Frequently Asked Questions

What is the IUPAC name of (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine?
The IUPAC name of (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine (CID 163415695) is (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine.
What is the SMILES notation for (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine?
The canonical SMILES for (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine is C=C1C=C2CCOC(CN)C2=C1.
What is the InChIKey of (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine?
The InChIKey is AEEUBRMIICMQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-7-4-8-2-3-12-10(6-11)9(8)5-7/h4-5,10H,1-3,6,11H2.
What are the key properties of (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine?
(6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine has a molecular weight of 163.22 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylidene-3,4-dihydro-1H-cyclopenta[c]pyran-1-yl)methanamine is sourced from PubChem (CID 163415695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).