1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine

C26H47N — CID 67842218

IUPAC1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine
SMILESCCCCCCCCCCCCCCC1(C2(C3(C4(N)CC4)CC3)CC2)CC1
InChIInChI=1S/C26H47N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23(15-16-23)24(17-18-24)25(19-20-25)26(27)21-22-26/h2-22,27H2,1H3
InChIKeyWZZWIZRBOQPMAD-UHFFFAOYSA-N
MW373.67 g/mol
LogP7.91
Rot. Bonds16

About 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine

1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine (PubChem CID 67842218) has the molecular formula C26H47N and a molecular weight of 373.67 g/mol. Its IUPAC name is 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine
PubChem CID67842218
Molecular FormulaC26H47N
Molecular Weight373.67 g/mol
Exact Mass373.37
IUPAC Name1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine
SMILESCCCCCCCCCCCCCCC1(C2(C3(C4(N)CC4)CC3)CC2)CC1
InChIInChI=1S/C26H47N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23(15-16-23)24(17-18-24)25(19-20-25)26(27)21-22-26/h2-22,27H2,1H3
InChIKeyWZZWIZRBOQPMAD-UHFFFAOYSA-N
XLogP7.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.67
LogP ≤ 57.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

ethane;1-ethyl-1-hexylcyclopropane
CID 143025428
1,1-dioctylcyclopentane
CID 54295272
1,1-dihexadecylcyclopentane
CID 141255150
1-decylcyclopropan-1-amine
CID 66023987
1,1-di(nonyl)cyclopentane
CID 154318487
1-pentylcyclopropan-1-amine
CID 66023547
1-octyl-1-prop-2-enylcyclopropane
CID 134979265
N-[(1-nonylcyclopropyl)methyl]propan-1-amine
CID 66025330
N-[(1-hexylcyclopropyl)methyl]propan-1-amine
CID 66026661
3,6-diethyl-3-hexyl-6-pentylazepane
CID 59903813
1,1-dipentylcyclononane
CID 169026027
1-hexyl-2,2-dimethylcyclopentan-1-amine
CID 79857458

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine?
The IUPAC name of 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine (CID 67842218) is 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine?
The canonical SMILES for 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine is CCCCCCCCCCCCCCC1(C2(C3(C4(N)CC4)CC3)CC2)CC1.
What is the InChIKey of 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine?
The InChIKey is WZZWIZRBOQPMAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H47N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23(15-16-23)24(17-18-24)25(19-20-25)26(27)21-22-26/h2-22,27H2,1H3.
What are the key properties of 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine?
1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine has a molecular weight of 373.67 g/mol, XLogP of 7.91, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(1-tetradecylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropan-1-amine is sourced from PubChem (CID 67842218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).