2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine

C17H25NO — CID 114712415

IUPAC2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(CC2CC2)Oc2ccccc21
InChIInChI=1S/C17H25NO/c1-3-10-18-15-12-17(2,11-13-8-9-13)19-16-7-5-4-6-14(15)16/h4-7,13,15,18H,3,8-12H2,1-2H3
InChIKeyYFTKYUDYMSXOMW-UHFFFAOYSA-N
MW259.39 g/mol
LogP4.07
Rot. Bonds5

About 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine

2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine (PubChem CID 114712415) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine
PubChem CID114712415
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(CC2CC2)Oc2ccccc21
InChIInChI=1S/C17H25NO/c1-3-10-18-15-12-17(2,11-13-8-9-13)19-16-7-5-4-6-14(15)16/h4-7,13,15,18H,3,8-12H2,1-2H3
InChIKeyYFTKYUDYMSXOMW-UHFFFAOYSA-N
XLogP4.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethyl)-N-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 114712262
2-(cyclobutylmethyl)-N-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 114712231
2-ethyl-2-methyl-N-pentyl-3,4-dihydrochromen-4-amine
CID 82462123
N,2,2-tripropyl-3,4-dihydrochromen-4-amine
CID 114712437
N-(2-ethyl-2-methyl-3,4-dihydrochromen-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 82462120
(4S)-2-(cyclobutylmethyl)-2-methyl-3,4-dihydrochromen-4-amine
CID 104945926
2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
CID 82462113
N-(3-butoxypropyl)-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 115704436
2'-methoxy-N-propylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 106875173
2,2-diethyl-N-pentyl-3,4-dihydrochromen-4-amine
CID 82462447
N-(2,2-dimethyl-3,4-dihydrochromen-4-yl)-N'-ethyl-N'-propylethane-1,2-diamine
CID 103787781
7-fluoro-2-methyl-2-pentyl-N-propyl-3,4-dihydrochromen-4-amine
CID 114713953

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine (CID 114712415) is 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine is CCCNC1CC(C)(CC2CC2)Oc2ccccc21.
What is the InChIKey of 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine?
The InChIKey is YFTKYUDYMSXOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-3-10-18-15-12-17(2,11-13-8-9-13)19-16-7-5-4-6-14(15)16/h4-7,13,15,18H,3,8-12H2,1-2H3.
What are the key properties of 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine?
2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine has a molecular weight of 259.39 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 114712415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).