ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane

C15H29N — CID 144873819

IUPACethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane
SMILESCC.CCC.Cc1cccc(C2(N)CC2)c1.[H][H]
InChIInChI=1S/C10H13N.C3H8.C2H6.H2/c1-8-3-2-4-9(7-8)10(11)5-6-10;1-3-2;1-2;/h2-4,7H,5-6,11H2,1H3;3H2,1-2H3;1-2H3;1H
InChIKeyIDOGGJMAAHNQIJ-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.63
Rot. Bonds1

About ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane

ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane (PubChem CID 144873819) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane.

Molecular Properties

Compound Nameethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane
PubChem CID144873819
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Nameethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane
SMILESCC.CCC.Cc1cccc(C2(N)CC2)c1.[H][H]
InChIInChI=1S/C10H13N.C3H8.C2H6.H2/c1-8-3-2-4-9(7-8)10(11)5-6-10;1-3-2;1-2;/h2-4,7H,5-6,11H2,1H3;3H2,1-2H3;1-2H3;1H
InChIKeyIDOGGJMAAHNQIJ-UHFFFAOYSA-N
XLogP4.63
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-methylphenyl)cyclopentan-1-amine
CID 43345653
3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine
CID 64751059
1-(3-methylphenyl)-3-propylcyclobutan-1-amine
CID 65013464
ethane;4-ethyl-4-(3-methylphenyl)oxane
CID 143442459
3-(3-methylphenyl)bicyclo[3.1.0]hexan-3-amine
CID 82405285
ethane;propane;1,3-xylene
CID 144528046
4-ethyl-4-(3-methylphenyl)oxane
CID 143442460
7,7-dimethyl-3-(3-methylphenyl)oxepan-3-amine
CID 122412891
1-(3-bromophenyl)cyclopropan-1-amine
CID 11127564
3-(1-aminocyclopropyl)phenol
CID 55296554
1-(3-propan-2-ylphenyl)cyclopropan-1-amine
CID 55268959
[1-(3-methylphenyl)cyclopropyl]methanol
CID 55253193

Frequently Asked Questions

What is the IUPAC name of ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane?
The IUPAC name of ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane (CID 144873819) is ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane.
What is the SMILES notation for ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane?
The canonical SMILES for ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane is CC.CCC.Cc1cccc(C2(N)CC2)c1.[H][H].
What is the InChIKey of ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane?
The InChIKey is IDOGGJMAAHNQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.C3H8.C2H6.H2/c1-8-3-2-4-9(7-8)10(11)5-6-10;1-3-2;1-2;/h2-4,7H,5-6,11H2,1H3;3H2,1-2H3;1-2H3;1H.
What are the key properties of ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane?
ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane has a molecular weight of 223.40 g/mol, XLogP of 4.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(3-methylphenyl)cyclopropan-1-amine;molecular hydrogen;propane is sourced from PubChem (CID 144873819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).