N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine

C14H23N — CID 115895728

IUPACN-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESC1CC2CC1CC2NCC1(C2CC2)CC1
InChIInChI=1S/C14H23N/c1-2-11-7-10(1)8-13(11)15-9-14(5-6-14)12-3-4-12/h10-13,15H,1-9H2
InChIKeyZAGOLYIMYCZWGU-UHFFFAOYSA-N
MW205.34 g/mol
LogP2.95
Rot. Bonds4

About N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine

N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 115895728) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound NameN-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID115895728
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESC1CC2CC1CC2NCC1(C2CC2)CC1
InChIInChI=1S/C14H23N/c1-2-11-7-10(1)8-13(11)15-9-14(5-6-14)12-3-4-12/h10-13,15H,1-9H2
InChIKeyZAGOLYIMYCZWGU-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine (CID 115895728) is N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine is C1CC2CC1CC2NCC1(C2CC2)CC1.
What is the InChIKey of N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is ZAGOLYIMYCZWGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-11-7-10(1)8-13(11)15-9-14(5-6-14)12-3-4-12/h10-13,15H,1-9H2.
What are the key properties of N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine?
N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 115895728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).