N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine

C17H32N2 — CID 167286767

IUPACN-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine
SMILESCCCNC1CC1CC(C)CNC1CC2CCC1C2
InChIInChI=1S/C17H32N2/c1-3-6-18-17-10-15(17)7-12(2)11-19-16-9-13-4-5-14(16)8-13/h12-19H,3-11H2,1-2H3
InChIKeyYUGSOOHGDQQFAV-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.18
Rot. Bonds8

About N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine

N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 167286767) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound NameN-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID167286767
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC NameN-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine
SMILESCCCNC1CC1CC(C)CNC1CC2CCC1C2
InChIInChI=1S/C17H32N2/c1-3-6-18-17-10-15(17)7-12(2)11-19-16-9-13-4-5-14(16)8-13/h12-19H,3-11H2,1-2H3
InChIKeyYUGSOOHGDQQFAV-UHFFFAOYSA-N
XLogP3.18
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine (CID 167286767) is N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine is CCCNC1CC1CC(C)CNC1CC2CCC1C2.
What is the InChIKey of N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is YUGSOOHGDQQFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-3-6-18-17-10-15(17)7-12(2)11-19-16-9-13-4-5-14(16)8-13/h12-19H,3-11H2,1-2H3.
What are the key properties of N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine?
N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 264.46 g/mol, XLogP of 3.18, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-[2-(propylamino)cyclopropyl]propyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 167286767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).