6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine

C10H17N — CID 175973770

IUPAC6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine
SMILESCC(C)=C1CC2CCCN2C1
InChIInChI=1S/C10H17N/c1-8(2)9-6-10-4-3-5-11(10)7-9/h10H,3-7H2,1-2H3
InChIKeyGOYHEUZINSJBSI-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.19
Rot. Bonds

About 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine

6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine (PubChem CID 175973770) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine.

Molecular Properties

Compound Name6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine
PubChem CID175973770
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine
SMILESCC(C)=C1CC2CCCN2C1
InChIInChI=1S/C10H17N/c1-8(2)9-6-10-4-3-5-11(10)7-9/h10H,3-7H2,1-2H3
InChIKeyGOYHEUZINSJBSI-UHFFFAOYSA-N
XLogP2.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(8S)-6-methylidene-1,2,3,5,7,8-hexahydropyrrolizine
CID 93233841
1,2,3,5,6,7,8,9,10,10a-decahydropyrrolo[1,2-b]isoquinoline
CID 101497236
2-ethyl-1,4,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-3-one
CID 130927080
6-methyl-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-one
CID 69483483
CID 175727151
CID 175727151
(3aS)-1,2,3,3a,4,10-hexahydro-[1]benzothiolo[2,3-f]indolizine
CID 101464496
1-(3-methylidene-4,6,7,8,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-2-yl)ethanone
CID 131092196
(8S)-14,16,23,25-tetraoxa-4-azaheptacyclo[18.7.0.02,10.04,8.011,19.013,17.022,26]heptacosa-1(27),2(10),11,13(17),18,20,22(26)-heptaene
CID 51352358
2-amino-4a,5,6,7,8,10-hexahydro-4H-thieno[3,2-b]quinolizine-3-carboxamide
CID 118318307
1-(1-cycloheptylpiperidin-3-yl)ethanone
CID 82926630
4-(2,3-dimethoxy-7,9,10,11,11a,12-hexahydronaphtho[2,1-f]indolizin-6-yl)butan-2-one
CID 11089516
2-ethyl-4,6,7,8,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-3-one
CID 130774971

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine?
The IUPAC name of 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine (CID 175973770) is 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine.
What is the SMILES notation for 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine?
The canonical SMILES for 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine is CC(C)=C1CC2CCCN2C1.
What is the InChIKey of 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine?
The InChIKey is GOYHEUZINSJBSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-8(2)9-6-10-4-3-5-11(10)7-9/h10H,3-7H2,1-2H3.
What are the key properties of 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine?
6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine has a molecular weight of 151.25 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylidene-1,2,3,5,7,8-hexahydropyrrolizine is sourced from PubChem (CID 175973770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).