(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane

C12H23N — CID 178040575

IUPAC(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane
SMILESC=C1CC[C@H](C)/C1=C/N(C)C.CC
InChIInChI=1S/C10H17N.C2H6/c1-8-5-6-9(2)10(8)7-11(3)4;1-2/h7,9H,1,5-6H2,2-4H3;1-2H3/b10-7+;/t9-;/m0./s1
InChIKeyQKWGSBMEQPFABR-ZAPXJDRDSA-N
MW181.32 g/mol
LogP3.44
Rot. Bonds1

About (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane

(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane (PubChem CID 178040575) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane.

Molecular Properties

Compound Name(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane
PubChem CID178040575
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane
SMILESC=C1CC[C@H](C)/C1=C/N(C)C.CC
InChIInChI=1S/C10H17N.C2H6/c1-8-5-6-9(2)10(8)7-11(3)4;1-2/h7,9H,1,5-6H2,2-4H3;1-2H3/b10-7+;/t9-;/m0./s1
InChIKeyQKWGSBMEQPFABR-ZAPXJDRDSA-N
XLogP3.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(dimethylaminomethylidene)-6-methyl-3-methylidenecyclohexan-1-one
CID 123735445
1-methyl-2-methylidenecyclobutane
CID 20800914
(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane
CID 142056566
(3S)-3-methyl-2-methylidenecyclopentan-1-one
CID 11789153
(2E)-2-ethylidene-3-methylidenecyclopentan-1-amine
CID 143343692
1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene
CID 13067250
(2Z)-2-(dimethylaminomethylidene)-4-methylcyclohexan-1-one
CID 63706279
tert-butyl N-[(2E)-2-ethylidene-3-methylidenecyclopentyl]-N-methylcarbamate
CID 134341594
1-methyl-2,3-dimethylidenecycloheptane
CID 20744103
methyl (2Z)-2-(dimethylaminomethylidene)-3-oxocyclopentane-1-carboxylate
CID 119053628
(2Z)-3-butyl-2-(dimethylaminomethylidene)cyclopentan-1-one
CID 12838021
ethane;(1Z,2Z)-1-ethylidene-3-methyl-2-prop-2-enylidenecyclohexane
CID 157035804

Frequently Asked Questions

What is the IUPAC name of (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane?
The IUPAC name of (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane (CID 178040575) is (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane.
What is the SMILES notation for (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane?
The canonical SMILES for (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane is C=C1CC[C@H](C)/C1=C/N(C)C.CC.
What is the InChIKey of (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane?
The InChIKey is QKWGSBMEQPFABR-ZAPXJDRDSA-N. The full InChI is InChI=1S/C10H17N.C2H6/c1-8-5-6-9(2)10(8)7-11(3)4;1-2/h7,9H,1,5-6H2,2-4H3;1-2H3/b10-7+;/t9-;/m0./s1.
What are the key properties of (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane?
(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane has a molecular weight of 181.32 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane is sourced from PubChem (CID 178040575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).