1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine

C15H25N3O — CID 103931540

IUPAC1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
SMILESCc1nc(CCNC2CC3CCC2(C)C3(C)C)no1
InChIInChI=1S/C15H25N3O/c1-10-17-13(18-19-10)6-8-16-12-9-11-5-7-15(12,4)14(11,2)3/h11-12,16H,5-9H2,1-4H3
InChIKeyMFRJHXACNSNPQN-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.72
Rot. Bonds4

About 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine

1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 103931540) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID103931540
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
SMILESCc1nc(CCNC2CC3CCC2(C)C3(C)C)no1
InChIInChI=1S/C15H25N3O/c1-10-17-13(18-19-10)6-8-16-12-9-11-5-7-15(12,4)14(11,2)3/h11-12,16H,5-9H2,1-4H3
InChIKeyMFRJHXACNSNPQN-UHFFFAOYSA-N
XLogP2.72
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine with MolForge

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Launch Full Analysis

Related Compounds

cis-(1R,3R)-1,2,2-trimethyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]cyclopentan-1-amine
CID 58477088
1,2,2-Trimethyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]cyclopentan-1-amine
CID 76798293
cis-(1S,3S)-3-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-N,1,2,2-tetramethylcyclopentan-1-amine
CID 130315398
cis-(1R,3R)-1,2,2-trimethyl-3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclopentan-1-amine
CID 130315455
trans-(1R,3R)-2,2-dimethyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]cyclopentan-1-amine
CID 130315456
(1R)-2,2-dimethyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]cyclopentan-1-amine
CID 144025962
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
CID 49124605
1,7,7-trimethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 55142724
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 61309757
3-[3-(2,2-Dimethylpropyl)-1,2,4-oxadiazol-5-yl]bicyclo[2.2.1]heptan-2-amine
CID 64379094
1,3,3-trimethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 64465065
N-[2-[3-(4,4-dimethylcyclohexyl)-1,2,4-oxadiazol-5-yl]ethyl]propan-2-amine
CID 65390169

Frequently Asked Questions

What is the IUPAC name of 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine (CID 103931540) is 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine is Cc1nc(CCNC2CC3CCC2(C)C3(C)C)no1.
What is the InChIKey of 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is MFRJHXACNSNPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-10-17-13(18-19-10)6-8-16-12-9-11-5-7-15(12,4)14(11,2)3/h11-12,16H,5-9H2,1-4H3.
What are the key properties of 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 263.38 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7,7-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 103931540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).