N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine

C15H21NO — CID 114711989

IUPACN,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
SMILESCNC1CC(C)(C2(C)CC2)Oc2ccccc21
InChIInChI=1S/C15H21NO/c1-14(8-9-14)15(2)10-12(16-3)11-6-4-5-7-13(11)17-15/h4-7,12,16H,8-10H2,1-3H3
InChIKeyWGTPZTYREYWZLF-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.29
Rot. Bonds2

About N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine

N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine (PubChem CID 114711989) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
PubChem CID114711989
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
SMILESCNC1CC(C)(C2(C)CC2)Oc2ccccc21
InChIInChI=1S/C15H21NO/c1-14(8-9-14)15(2)10-12(16-3)11-6-4-5-7-13(11)17-15/h4-7,12,16H,8-10H2,1-3H3
InChIKeyWGTPZTYREYWZLF-UHFFFAOYSA-N
XLogP3.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
CID 82462113
N,2-dimethyl-2-(2-phenylethyl)-3,4-dihydrochromen-4-amine
CID 114712083
N,3',5'-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114711957
N,3'-dimethylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114240817
6-bromo-N-ethyl-2-methyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
CID 114713374
7-bromo-N,2,2-trimethyl-3,4-dihydrochromen-4-amine
CID 79982958
3'-methoxy-N-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 106875170
N-methyl-4'-propan-2-ylspiro[3,4-dihydrochromene-2,1'-cycloheptane]-4-amine
CID 114712137
N-methyl-2'-propan-2-ylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114712062
N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 114711983
N-ethyl-7-methoxy-2-methyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
CID 114710986
N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 84618813

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine?
The IUPAC name of N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine (CID 114711989) is N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine.
What is the SMILES notation for N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine?
The canonical SMILES for N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine is CNC1CC(C)(C2(C)CC2)Oc2ccccc21.
What is the InChIKey of N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine?
The InChIKey is WGTPZTYREYWZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-14(8-9-14)15(2)10-12(16-3)11-6-4-5-7-13(11)17-15/h4-7,12,16H,8-10H2,1-3H3.
What are the key properties of N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine?
N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine has a molecular weight of 231.34 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 114711989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).