N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine

C19H25NO — CID 116722797

IUPACN-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine
SMILESCCCNC(c1cccc2ccccc12)C(OC)C1CC1
InChIInChI=1S/C19H25NO/c1-3-13-20-18(19(21-2)15-11-12-15)17-10-6-8-14-7-4-5-9-16(14)17/h4-10,15,18-20H,3,11-13H2,1-2H3
InChIKeySWVSUSTWNQSDQE-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.31
Rot. Bonds7

About N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine

N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine (PubChem CID 116722797) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine
PubChem CID116722797
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC NameN-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine
SMILESCCCNC(c1cccc2ccccc12)C(OC)C1CC1
InChIInChI=1S/C19H25NO/c1-3-13-20-18(19(21-2)15-11-12-15)17-10-6-8-14-7-4-5-9-16(14)17/h4-10,15,18-20H,3,11-13H2,1-2H3
InChIKeySWVSUSTWNQSDQE-UHFFFAOYSA-N
XLogP4.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-cyclopropyl-2-methoxy-1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 116722720
N-[1-(4-chlorophenyl)-2-cyclopropyl-2-methoxyethyl]propan-1-amine
CID 116722802
N-[2-cyclopropyl-1-(3-fluoro-4-pyridinyl)-2-methoxyethyl]propan-1-amine
CID 116722908
2-cyclohexyl-2-methoxy-1-naphthalen-1-ylethanol
CID 116756473
N-[2-cyclopropyl-1-(3,5-dimethoxyphenyl)-2-methoxyethyl]propan-1-amine
CID 116722688
N-[2-cyclopropyl-2-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]ethyl]propan-1-amine
CID 102708548
N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine
CID 62116847
N-(1-isoquinolin-4-yl-2,2-dimethoxyethyl)propan-1-amine
CID 79492792
N-[2-cyclohexyl-1-(furan-3-yl)-2-methoxyethyl]propan-1-amine
CID 116771848
N-(2-cyclohexyl-1-cyclopropyl-2-methoxyethyl)propan-1-amine
CID 116771906
1-(4-bromonaphthalen-1-yl)-2-cyclopropyl-N-propylpropan-1-amine
CID 83149935
1-(3-bromo-2-fluorophenyl)-2-cyclohexyl-N-ethyl-2-methoxyethanamine
CID 106646184

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine?
The IUPAC name of N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine (CID 116722797) is N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine.
What is the SMILES notation for N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine?
The canonical SMILES for N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine is CCCNC(c1cccc2ccccc12)C(OC)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine?
The InChIKey is SWVSUSTWNQSDQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-13-20-18(19(21-2)15-11-12-15)17-10-6-8-14-7-4-5-9-16(14)17/h4-10,15,18-20H,3,11-13H2,1-2H3.
What are the key properties of N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine?
N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine has a molecular weight of 283.41 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine is sourced from PubChem (CID 116722797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).