N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine

C19H25NO — CID 43475302

IUPACN-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine
SMILESCC(C)COc1c(C(C)NC2CC2)ccc2ccccc12
InChIInChI=1S/C19H25NO/c1-13(2)12-21-19-17(14(3)20-16-9-10-16)11-8-15-6-4-5-7-18(15)19/h4-8,11,13-14,16,20H,9-10,12H2,1-3H3
InChIKeyXESGLIWDZKEFEC-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.69
Rot. Bonds6

About N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine

N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine (PubChem CID 43475302) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine
PubChem CID43475302
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC NameN-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine
SMILESCC(C)COc1c(C(C)NC2CC2)ccc2ccccc12
InChIInChI=1S/C19H25NO/c1-13(2)12-21-19-17(14(3)20-16-9-10-16)11-8-15-6-4-5-7-18(15)19/h4-8,11,13-14,16,20H,9-10,12H2,1-3H3
InChIKeyXESGLIWDZKEFEC-UHFFFAOYSA-N
XLogP4.69
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1-propoxynaphthalen-2-yl)ethyl]cyclopropanamine
CID 43475308
N-[1-(1-but-2-ynoxynaphthalen-2-yl)ethyl]cyclopropanamine
CID 62311521
N-[1-[1-[(E)-3-chloroprop-2-enoxy]naphthalen-2-yl]ethyl]cyclopropanamine
CID 60888648
N-(1-naphthalen-1-ylethyl)cyclopropanamine
CID 16775384
molecular hydrogen;N-[(1R)-1-naphthalen-1-ylethyl]cyclohexanamine
CID 143807841
N-[1-[1-(2,2-difluoroethoxy)naphthalen-2-yl]ethyl]propan-2-amine
CID 60921222
1-[1-(2-ethylbutoxy)naphthalen-2-yl]-N-methylethanamine
CID 82926079
N-(1-naphthalen-1-ylethyl)-1,1-dioxothian-4-amine
CID 43511636
2-[1-[(3-methoxycyclopentyl)amino]ethyl]naphthalen-1-ol
CID 103083012
N-[(1R)-1-naphthalen-1-ylethyl]azetidin-3-amine
CID 58973497
2-[2-[(1S)-1-aminoethyl]naphthalen-1-yl]oxy-N-cyclopropylacetamide
CID 63368493
N-[1-(2-propan-2-yloxyphenyl)ethyl]cyclopropanamine
CID 103439093

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine?
The IUPAC name of N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine (CID 43475302) is N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine.
What is the SMILES notation for N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine?
The canonical SMILES for N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine is CC(C)COc1c(C(C)NC2CC2)ccc2ccccc12.
What is the InChIKey of N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine?
The InChIKey is XESGLIWDZKEFEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13(2)12-21-19-17(14(3)20-16-9-10-16)11-8-15-6-4-5-7-18(15)19/h4-8,11,13-14,16,20H,9-10,12H2,1-3H3.
What are the key properties of N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine?
N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine has a molecular weight of 283.41 g/mol, XLogP of 4.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-(2-methylpropoxy)naphthalen-2-yl]ethyl]cyclopropanamine is sourced from PubChem (CID 43475302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).